SCHEMBL9302410

SCHEMBL9302410

COc1ccc(NS(=O)(=O)c2ccc(CC3(C)Nc4ccccc4N3)cc2)cc1OC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.56
HTT P42858 4/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
ALOX15 P16050 1/20 0.52
MAPK1 P28482 1/20 0.52
CA12 O43570 1/20 0.51
CA9 Q16790 1/20 0.51
NAMPT P43490 1/20 0.48
ALDH1A1 P00352 2/20 0.47
MAPT P10636 3/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
OGT O15294 1/20 0.47
TP53 P04637 1/20 0.47
TSHR P16473 2/20 0.47
HTR6 P50406 1/20 0.47
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
PKM P14618 1/20 0.46
CYP2C19 P33261 1/20 0.46

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
SCHEMBL9302429 0.89 TP53 (0.45) LMNAHTTSMN1; SMN2ALOX15MAPK1
SCHEMBL9303638 0.85 SMN1; SMN2 (0.52) LMNAHTTSMN1; SMN2MAPK1ALDH1A1
SCHEMBL9303510 0.80 ALOX15 (0.53) LMNAALOX15NAMPTALDH1A1MAPT
SCHEMBL9302374 0.80 CACNA1B (0.53) LMNASMN1; SMN2MAPK1ALDH1A1MAPT
SCHEMBL399122 0.77 LMNA (0.77) LMNAHTTSMN1; SMN2ALOX15MAPK1
SCHEMBL9302425 0.77 ITGA1 (0.58) NAMPTALDH1A1MAPTPOLBMEN1
SCHEMBL6038182 0.74 LMNA (0.68) LMNAHTTSMN1; SMN2ALOX15MAPK1
SCHEMBL29048773 0.73 LMNA (0.79) LMNAHTTSMN1; SMN2ALOX15MAPK1
SCHEMBL30532978 0.73 LMNA (0.79) LMNAHTTSMN1; SMN2ALOX15MAPK1
SCHEMBL6037954 0.72 LMNA (0.77) LMNAHTTSMN1; SMN2ALOX15MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0468971-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1992-02-05 EP claimed
WO-1990009997-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1990-09-07 WO claimed
US-5314880-A Platelet activating factor antagonist BRITISH BIO-TECHNOLOGY LIMITED (GB) 1994-05-24 US disclosed
EP-0468971-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1992-02-05 EP disclosed
WO-1990009997-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1990-09-07 WO disclosed