SCHEMBL9301970

SCHEMBL9301970

Cc1nc2ccccc2n1Cc1ccc(S(=O)(=O)NCc2cccc(Cl)c2)cc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GALR3 O60755 2/20 0.57
NR2F2 P24468 2/20 0.57
RAB9A P51151 1/20 0.57
TBXAS1 P24557 3/20 0.56
GNRHR P30968 6/20 0.55
TNF P01375 1/20 0.54
CYP19A1 P11511 1/20 0.50
PTAFR P25105 1/20 0.49
ALDH1A1 P00352 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
TP53 P04637 1/20 0.48

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
SCHEMBL9304259 0.89 GALR3 (0.69) GALR3NR2F2RAB9AGNRHRTNF
SCHEMBL9303506 0.84 GALR3 (0.58) GALR3NR2F2RAB9ATNFCYP19A1
SCHEMBL9303635 0.84 LMNA (0.59) GALR3NR2F2RAB9ATBXAS1GNRHR
SCHEMBL9302325 0.83 GALR3 (0.56) GALR3NR2F2RAB9ATBXAS1TNF
SCHEMBL9303024 0.81 PTAFR (0.58) GALR3NR2F2RAB9ATNFPTAFR
SCHEMBL9302805 0.79 TNF (0.53) GALR3NR2F2RAB9ATBXAS1TNF
SCHEMBL8137536 0.79 TNF (0.59) GALR3NR2F2RAB9ATBXAS1TNF
SCHEMBL9298879 0.78 TNF (0.57) GALR3NR2F2RAB9AGNRHRTNF
SCHEMBL8129105 0.77 HDAC1 (0.56) GALR3NR2F2RAB9ATBXAS1TNF
SCHEMBL1160088 0.77 POLB (0.51) GALR3NR2F2RAB9ATBXAS1GNRHR

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