SCHEMBL9303763

SCHEMBL9303763

Cc1nc2ccccc2n1Cc1ccc(S(=O)(=O)NC2CCCc3ccccc32)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 2/20 0.55
ALDH1A1 P00352 6/20 0.54
HTT P42858 2/20 0.54
CYP1A2 P05177 1/20 0.52
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.47
MAPK1 P28482 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
TSHR P16473 1/20 0.47
HPGD P15428 2/20 0.47
TP53 P04637 1/20 0.47
CHEK2 O96017 1/20 0.47
GALR3 O60755 2/20 0.47
NR2F2 P24468 2/20 0.47
RAB9A P51151 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
LMNA P02545 1/20 0.47
STAT3 P40763 1/20 0.47
TNF P01375 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
SCHEMBL9303746 0.81 PTAFR (0.67) PTAFRALDH1A1SMN1; SMN2TSHRGALR3
SCHEMBL9302266 0.76 PTAFR (0.55) PTAFRALDH1A1CYP1A2GALR3NR2F2
SCHEMBL9302291 0.76 PTAFR (0.55) PTAFRALDH1A1HTTGALR3NR2F2
SCHEMBL30305355 0.76 ALDH1A1 (0.75) ALDH1A1HTTCYP1A2MEN1KMT2A
SCHEMBL29019314 0.76 ALDH1A1 (0.75) ALDH1A1HTTCYP1A2MEN1KMT2A
SCHEMBL9303050 0.74 PTAFR (0.59) PTAFRALDH1A1GALR3NR2F2RAB9A
SCHEMBL31005217 0.73 CYP1A2 (0.78) ALDH1A1HTTCYP1A2MEN1KMT2A
SCHEMBL4788494 0.73 CYP1A2 (0.78) ALDH1A1HTTCYP1A2MEN1KMT2A
SCHEMBL9302155 0.73 PTAFR (0.58) PTAFRALDH1A1GALR3NR2F2RAB9A
SCHEMBL9303064 0.73 PTAFR (0.52) PTAFRALDH1A1GALR3NR2F2RAB9A

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 4 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
WO-1990009997-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1990-09-07 WO disclosed