SCHEMBL17100728

SCHEMBL17100728

O=S(=O)(c1ccc(OC(F)F)cc1)N1CCN(c2nc(Cc3ccccc3)no2)CC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
ALDH1A1 P00352 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
PTGDR Q13258 3/20 0.41
PKM P14618 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
KDM2B Q8NHM5 1/20 0.40
GBA1 P04062 4/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HPGD P15428 1/20 0.38
TSHR P16473 2/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL17100794 0.91 LMNA (0.44) LMNAALDH1A1SMN1; SMN2PTGDRKDM2B
SCHEMBL17100735 0.90 ALDH1A1 (0.44) LMNAALDH1A1SMN1; SMN2PTGDRPKM
SCHEMBL17100787 0.90 MEN1 (0.40) LMNAALDH1A1SMN1; SMN2PTGDRPKM
SCHEMBL17100677 0.89 ALDH1A1 (0.46) LMNAALDH1A1SMN1; SMN2PTGDRPKM
SCHEMBL17100713 0.87 PKM (0.57) LMNAALDH1A1SMN1; SMN2PKMGBA1
SCHEMBL17100859 0.87 ALDH1A1 (0.39) LMNAALDH1A1SMN1; SMN2PTGDRPKM
SCHEMBL17100932 0.85 L3MBTL1 (0.58) LMNAALDH1A1SMN1; SMN2PKML3MBTL1
SCHEMBL17100956 0.84 LMNA (0.42) LMNAALDH1A1SMN1; SMN2PTGDRPKM
SCHEMBL17100852 0.83 LMNA (0.42) LMNAALDH1A1SMN1; SMN2PTGDRKDM2B
SCHEMBL17100682 0.83 LMNA (0.43) LMNAALDH1A1SMN1; SMN2PTGDRPKM

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200140400-A1 OXADIAZOLE COMPOUNDS REMYND NV (BE) 2020-05-07 US claimed
US-10562869-B2 Oxadiazole compounds REMYND NV (BE) 2020-02-18 US claimed
US-20170073319-A1 OXADIAZOLE COMPOUNDS REMYND NV (BE) 2017-03-16 US claimed
US-20200140400-A1 OXADIAZOLE COMPOUNDS REMYND NV (BE) 2020-05-07 US disclosed
US-20200140400-A1 OXADIAZOLE COMPOUNDS REMYND NV (BE) 2020-05-07 US disclosed
US-10562869-B2 Oxadiazole compounds REMYND NV (BE) 2020-02-18 US disclosed
US-10562869-B2 Oxadiazole compounds REMYND NV (BE) 2020-02-18 US disclosed
US-20170073319-A1 OXADIAZOLE COMPOUNDS REMYND NV (BE) 2017-03-16 US disclosed
US-20170073319-A1 OXADIAZOLE COMPOUNDS REMYND NV (BE) 2017-03-16 US disclosed
US-20170073319-A1 OXADIAZOLE COMPOUNDS REMYND NV (BE) 2017-03-16 US disclosed
EP-3119774-A1 OXADIAZOLE COMPOUNDS reMynd NV (BE) 2017-01-25 EP disclosed
WO-2015140130-A1 OXADIAZOLE COMPOUNDS REMYND NV (BE) 2015-09-24 WO 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 (3 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-10562869-B2 Oxadiazole compounds OXA1L, PSEN1, MAPT LMNA 760/4885ALDH1A1 482/4885SMN1; SMN2 11/4885
US-20200140400-A1 OXADIAZOLE COMPOUNDS OXA1L, PSEN1, MAPT LMNA 748/4885ALDH1A1 561/4885SMN1; SMN2 11/4885
US-20170073319-A1 OXADIAZOLE COMPOUNDS OXA1L, PSEN1, MAPT LMNA 760/4885ALDH1A1 482/4885SMN1; SMN2 11/4885

“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.