SCHEMBL15724378

SCHEMBL15724378

CCN(CC)S(=O)(=O)c1ccc(-c2cccnc2C(C)C)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 5/20 0.55
▸ HTT P42858 4/20 0.55
▸ SMN1; SMN2 Q16637 3/20 0.55
▸ TP53 P04637 1/20 0.48
▸ NPC1 O15118 3/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ HPGD P15428 2/20 0.46
▸ ALDH1A1 P00352 7/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ GAA P10253 3/20 0.45
▸ MAPT P10636 2/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ KDM1A O60341 1/20 0.42
▸ MAOA P21397 1/20 0.42
▸ MAOB P27338 1/20 0.42
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL15730736 0.86 HTT (0.62) LMNAHTTSMN1; SMN2TP53NPC1
SCHEMBL15723918 0.85 PTGS2 (0.43) LMNAHTTSMN1; SMN2TP53NPC1
SCHEMBL15723919 0.83 LMNA (0.54) LMNAHTTSMN1; SMN2TP53NPC1
SCHEMBL14555904 0.80 PTGS2 (0.61) PTGS1PTGS2
SCHEMBL14555429 0.79 CA2 (0.60) PTGS1PTGS2
SCHEMBL18853896 0.76 DRD1 (0.50) LMNAHTTSMN1; SMN2NPC1RAB9A
SCHEMBL18853879 0.75 NPSR1 (0.48) SMN1; SMN2ALDH1A1GAAMEN1KMT2A
SCHEMBL15723958 0.74 LMNA (0.50) LMNAHTTSMN1; SMN2HPGDALDH1A1
SCHEMBL20371668 0.74 ALDH1A1 (0.55) SMN1; SMN2HPGDALDH1A1KDM4EHSD17B10
SCHEMBL15723888 0.73 OPRM1 (0.39) LMNASMN1; SMN2TP53NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230012449-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2023-01-12 — — US disclosed
US-11034668-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2021-06-15 — — US disclosed
US-10370358-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2019-08-06 — — US disclosed
US-20180194746-A1 Compounds For the Treatment of HIV GILEAD SCIENCES, INC. 2018-07-12 — — US disclosed
US-20180194746-A1 Compounds For the Treatment of HIV GILEAD SCIENCES, INC. 2018-07-12 — — US disclosed
US-9944619-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2018-04-17 — — US disclosed
US-9944619-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2018-04-17 — — US disclosed
US-20170137405-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2017-05-18 — — US disclosed
US-20170137405-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2017-05-18 — — US disclosed
US-20140142085-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. (US) 2014-05-22 — — 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 (6 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-10370358-B2 Compounds for the treatment of HIV CCR5, NPC1, FURIN LMNA 3182/4885HTT 4049/4885SMN1; SMN2 3500/4885
US-20180194746-A1 Compounds For the Treatment of HIV CCR5, NPC1, FURIN LMNA 3182/4885HTT 4049/4885SMN1; SMN2 3500/4885
US-11034668-B2 Compounds for the treatment of HIV CCR5, NPC1, FURIN LMNA 3182/4885HTT 4049/4885SMN1; SMN2 3500/4885
US-20170137405-A1 COMPOUNDS FOR THE TREATMENT OF HIV CCR5, NPC1, FURIN LMNA 3182/4885HTT 4049/4885SMN1; SMN2 3500/4885
US-20140142085-A1 COMPOUNDS FOR THE TREATMENT OF HIV CCR5, NPC1, FURIN LMNA 3182/4885HTT 4049/4885SMN1; SMN2 3500/4885
US-20230012449-A1 COMPOUNDS FOR THE TREATMENT OF HIV CCR5, NPC1, FURIN LMNA 3182/4885HTT 4049/4885SMN1; SMN2 3500/4885

“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.

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