SCHEMBL9302374

SCHEMBL9302374

CC1(Cc2ccc(S(=O)(=O)Nc3cccc(Oc4ccccc4)c3)cc2)Nc2ccccc2N1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 2/20 0.53
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
PGR P06401 5/20 0.48
CACNA1H O95180 1/20 0.47
FFAR1 O14842 2/20 0.46
FFAR4 Q5NUL3 1/20 0.46
BRAF P15056 1/20 0.45
GPR119 Q8TDV5 2/20 0.45
LMNA P02545 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
ALDH1A1 P00352 2/20 0.45
PKM P14618 1/20 0.45
HPGD P15428 1/20 0.45
MAPT P10636 1/20 0.45
MAPK1 P28482 1/20 0.45
LIMK2 P53671 1/20 0.44
GRIN1 Q05586 1/20 0.44
GRIN2B Q13224 1/20 0.44
CYP19A1 P11511 1/20 0.43

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
SCHEMBL9303510 0.84 ALOX15 (0.53) MEN1KMT2APGRLMNAALDH1A1
SCHEMBL9302425 0.82 ITGA1 (0.58) MEN1KMT2AALDH1A1MAPT
SCHEMBL9302410 0.80 LMNA (0.56) MEN1KMT2ALMNASMN1; SMN2ALDH1A1
SCHEMBL9302429 0.77 TP53 (0.45) MEN1KMT2ALMNASMN1; SMN2ALDH1A1
SCHEMBL15474245 0.73 FFAR1 (0.74) CACNA1BMEN1KMT2APGRFFAR1
SCHEMBL17468424 0.71 PGR (0.65) CACNA1BMEN1KMT2APGRCACNA1H
SCHEMBL15472299 0.70 PGR (0.63) CACNA1BMEN1KMT2APGRFFAR1
SCHEMBL9303870 0.70 CA2 (0.47) SMN1; SMN2MAPT
SCHEMBL9301975 0.70 CYP19A1 (0.54) CYP19A1
SCHEMBL9303638 0.69 SMN1; SMN2 (0.52) LMNASMN1; SMN2ALDH1A1PKMMAPT

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