SCHEMBL9303638

SCHEMBL9303638

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

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.52
MAPT P10636 2/20 0.52
HTT P42858 2/20 0.52
LMNA P02545 2/20 0.52
ALDH1A1 P00352 3/20 0.49
PKM P14618 1/20 0.48
LARS1 Q9P2J5 2/20 0.48
MAPK1 P28482 1/20 0.47
CYP19A1 P11511 1/20 0.47

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
SCHEMBL9302410 0.85 LMNA (0.56) SMN1; SMN2MAPTHTTLMNAALDH1A1
SCHEMBL9301975 0.81 CYP19A1 (0.54) CYP19A1
SCHEMBL28195553 0.81 HTT (0.75) SMN1; SMN2MAPTHTTLMNAALDH1A1
SCHEMBL9304262 0.81 ALDH1A1 (0.54) LMNAALDH1A1MAPK1CYP19A1
SCHEMBL9302429 0.78 TP53 (0.45) SMN1; SMN2MAPTHTTLMNAALDH1A1
SCHEMBL28003775 0.77 SMN1; SMN2 (0.74) SMN1; SMN2MAPTHTTLMNAALDH1A1
SCHEMBL9302327 0.76 POLB (0.56) MAPTHTTLMNAALDH1A1MAPK1
SCHEMBL7415584 0.73 SMN1; SMN2 (0.78) SMN1; SMN2MAPTHTTLMNAALDH1A1
SCHEMBL9302813 0.73 ALDH1A1 (0.48) SMN1; SMN2HTTLMNAALDH1A1PKM
SCHEMBL30596341 0.72 SMN1; SMN2 (0.59) SMN1; SMN2MAPTHTTLMNAALDH1A1

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