SCHEMBL58906

SCHEMBL58906

COC(=O)c1cccc(C(=N)NC(=O)c2ccccc2F)c1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.60
L3MBTL1 Q9Y468 2/20 0.60
PYGL P06737 2/20 0.56
MAPT P10636 3/20 0.50
HPGD P15428 2/20 0.50
KDM4E B2RXH2 1/20 0.50
KMT2A Q03164 3/20 0.49
RAB9A P51151 6/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
NPC1 O15118 6/20 0.48
POLB P06746 1/20 0.47
PKM P14618 1/20 0.47
MEN1 O00255 2/20 0.46
GAA P10253 1/20 0.45
DNMT1 P26358 1/20 0.44
CASP6 P55212 1/20 0.44
MCL1 Q07820 1/20 0.44
LMNA P02545 1/20 0.44
KAT6A Q92794 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31736572 1.00 ALDH1A1 (0.60) ALDH1A1L3MBTL1PYGLMAPTHPGD
SCHEMBL28503213 0.85 ALDH1A1 (0.54) ALDH1A1L3MBTL1PYGLKMT2ARAB9A
SCHEMBL28637889 0.84 KAT6A (0.54) ALDH1A1L3MBTL1MAPTHPGDKDM4E
SCHEMBL1818135 0.78 ALDH1A1 (0.80) ALDH1A1L3MBTL1MAPTHPGDKMT2A
SCHEMBL10298010 0.77 TSHR (0.53) ALDH1A1L3MBTL1KDM4ERAB9ANPC1
SCHEMBL28500714 0.76 ALDH1A1 (0.59) ALDH1A1L3MBTL1PYGLMAPTHPGD
SCHEMBL29215335 0.75 ALDH1A1 (0.64) ALDH1A1L3MBTL1PYGLMAPTHPGD
SCHEMBL60081 0.74 TSHR (0.52) ALDH1A1L3MBTL1MAPTKMT2ARAB9A
SCHEMBL31736470 0.73 ALDH1A1 (0.48) ALDH1A1L3MBTL1PYGLMAPTKMT2A
SCHEMBL4238456 0.73 ALDH1A1 (0.67) ALDH1A1L3MBTL1PYGLMAPTHPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 95 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100121070-A1 METHODS FOR THE SYNTHESIS OF 1,2,4-OXADIAZOLE BENZOIC ACID COMPOUNDS PTC THERAPEUTICS, INC. 2010-05-13 US claimed
EP-4101846-B1 1,2,4-OXADIAZOLE BENZOIC ACID COMPOUNDS AND THEIR USE FOR NONSENSE SUPPRESSION AND THE TREATMENT OF DISEASE PTC THERAPEUTICS INC (US) 2023-08-02 EP disclosed
US-20230218587-A1 COMPOSITIONS FOR AN ORALLY ACTIVE 1,2,4-OXADIAZOLE FOR THE TREATMENT OF DISEASE PTC THERAPEUTICS INC (US) 2023-07-13 US disclosed
EP-4101846-A1 1,2,4-OXADIAZOLE BENZOIC ACID COMPOUNDS AND THEIR USE FOR NONSENSE SUPPRESSION AND THE TREATMENT OF DISEASE PTC Therapeutics, Inc. (US) 2022-12-14 EP disclosed
US-11497736-B2 Compositions for an orally active 1,2,4-oxadiazole for the treatment of disease PTC THERAPEUTICS, INC. (US) 2022-11-15 US disclosed
EP-3889142-B1 1,2,4-OXADIAZOLE BENZOIC ACID COMPOUNDS AND THEIR USE FOR NONSENSE SUPPRESSION AND THE TREATMENT OF DISEASE PTC THERAPEUTICS INC (US) 2022-06-15 EP disclosed
EP-3889142-A1 1,2,4-OXADIAZOLE BENZOIC ACID COMPOUNDS AND THEIR USE FOR NONSENSE SUPPRESSION AND THE TREATMENT OF DISEASE PTC Therapeutics, Inc. (US) 2021-10-06 EP disclosed
EP-3632902-B1 1,2,4-OXADIAZOLE BENZOIC ACID COMPOUND AND ITS USE FOR NONSENSE SUPPRESSION AND THE TREATMENT OF DISEASE PTC THERAPEUTICS INC (US) 2021-07-14 EP disclosed
EP-3549936-B1 1,2,4-OXADIAZOLE BENZOIC ACID COMPOUND AND ITS USE FOR NONSENSE SUPPRESSION AND THE TREATMENT OF DISEASE PTC THERAPEUTICS INC (US) 2021-06-02 EP disclosed
US-20210038572-A1 METHODS FOR DOSING AN ORALLY ACTIVE 1,2,4-OXADIAZOLE FOR NONSENSE MUTATION SUPPRESSION THERAPY PTC THERAPEUTICS, INC. 2021-02-11 US disclosed
US-7202262-B2 E.g., 3-(5-p-tolyl-[1,2,4]oxadiazol-3-yl)-benzoic acid; translation of mRNA is allowed to continue past a nonsense mutation point, resulting in the production of a full length protein; genetic disorders PTC THERAPEUTICS, INC. (US) 2007-04-10 US disclosed
WO-2006110483-A1 COMPOSITIONS OF AN ORALLY ACTIVE 1,2,4-OXADIAZOLE FOR NONSENSE MUTATION SUPPRESSION THERAPY PTC THERAPEUTICS, INC. (US) 2006-10-19 WO disclosed
US-20060148864-A1 Treating or preventing a disease ameliorated by modulation of premature translation termination or nonsense-mediated mRNA decay such as genetic disorders PTC THERAPEUTICS, INC. 2006-07-06 US disclosed
US-20060148863-A1 E.g., 3-[5-(2-Chloro-pyridin-3-yl)-[1,2,4]oxadiazol-3-yl]-benzoic acid; treating or preventing a disease ameliorated by modulation of premature translation termination or nonsense-mediated mRNA decay such as genetic disorders PTC THERAPEUTICS, INC. 2006-07-06 US disclosed
US-20060035943-A1 E.g., 3-(5-p-tolyl-[1,2,4]oxadiazol-3-yl)-benzoic acid; treating or preventing a disease ameliorated by modulation of premature translation termination or nonsense-mediated mRNA decay such as genetic disorders PTC THERAPEUTICS, INC. 2006-02-16 US disclosed
US-6992096-B2 translation of mRNA is allowed to continue past a nonsense mutation point, resulting in the production of a full length protein; genetic disorders; 3-(5-p-tolyl-[1,2,4]oxadiazol-3-yl)-benzoic acid PTC THERAPEUTICS, INC. (US) 2006-01-31 US disclosed
EP-1618098-A2 1,2,4-OXADIAZOLE BENZOIC ACID COMPOUNDS AND THEIR USE FOR NONSENSE SUPPRESSION AND THE TREATMENT OF DISEASE PCT Therapeutics Inc. (US) 2006-01-25 EP disclosed
US-20050164973-A1 E.g., 3-[5-(4-Fluoro-phenyl)-[1,2,4]oxadiazol-3-yl]-benzoic acid; treating diseases ameliorated by modulation of premature translation termination or nonsense-mediated mRNA decay PCT THERAPEUTICS, INC. 2005-07-28 US disclosed
WO-2004091502-A2 1,2,4-OXADIAZOLE BENZOIC ACID COMPOUNDS PTC THERAPEUTICS, INC. (US) 2004-10-28 WO disclosed
US-20040204461-A1 translation of mRNA is allowed to continue past a nonsense mutation point, resulting in the production of a full length protein; genetic disorders; 3-(5-p-tolyl-[1,2,4]oxadiazol-3-yl)-benzoic acid PTC THERAPEUTICS, INC. 2004-10-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11497736-B2 Compositions for an orally active 1,2,4-oxadiazole for the treatment of disease SMN1; SMN2, UPF1, VHL ALDH1A1 1412/4885L3MBTL1 122/4885PYGL 520/4885
US-20100121070-A1 METHODS FOR THE SYNTHESIS OF 1,2,4-OXADIAZOLE BENZOIC ACID COMPOUNDS UPF1, RIOX2, RNMT ALDH1A1 1628/4885L3MBTL1 236/4885PYGL 757/4885
US-20210038572-A1 METHODS FOR DOSING AN ORALLY ACTIVE 1,2,4-OXADIAZOLE FOR NONSENSE MUTATION SUPPRESSION THERAPY UPF1, VHL, SLC25A21 ALDH1A1 1185/4885L3MBTL1 16/4885PYGL 1717/4885
US-20230218587-A1 COMPOSITIONS FOR AN ORALLY ACTIVE 1,2,4-OXADIAZOLE FOR THE TREATMENT OF DISEASE SMN1; SMN2, UPF1, VHL ALDH1A1 1412/4885L3MBTL1 122/4885PYGL 520/4885
US-20060148864-A1 Treating or preventing a disease ameliorated by modulation of premature translation termination or nonsense-mediated mRNA decay such as genetic disorders UPF1, PABPC1, PABPC4 ALDH1A1 2018/4885L3MBTL1 51/4885PYGL 1615/4885
US-20060035943-A1 E.g., 3-(5-p-tolyl-[1,2,4]oxadiazol-3-yl)-benzoic acid; treating or preventing a disease ameliorated by modulation of premature translation termination or nonsense-mediated mRNA decay such as genetic disorders UPF1, PABPC1, PABPC4 ALDH1A1 1785/4885L3MBTL1 42/4885PYGL 1401/4885
US-20060148863-A1 E.g., 3-[5-(2-Chloro-pyridin-3-yl)-[1,2,4]oxadiazol-3-yl]-benzoic acid; treating or preventing a disease ameliorated by modulation of premature translation termination or nonsense-mediated mRNA decay such as genetic disorders UPF1, PABPC1, PABPC4 ALDH1A1 2175/4885L3MBTL1 49/4885PYGL 989/4885
US-20050164973-A1 E.g., 3-[5-(4-Fluoro-phenyl)-[1,2,4]oxadiazol-3-yl]-benzoic acid; treating diseases ameliorated by modulation of premature translation termination or nonsense-mediated mRNA decay UPF1, PABPC1, PABPC4 ALDH1A1 1665/4885L3MBTL1 107/4885PYGL 1008/4885
US-20040204461-A1 translation of mRNA is allowed to continue past a nonsense mutation point, resulting in the production of a full length protein; genetic disorders; 3-(5-p-tolyl-[1,2,4]oxadiazol-3-yl)-benzoic acid UPF1, PABPC1, PABPC4 ALDH1A1 2766/4885L3MBTL1 78/4885PYGL 2292/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.