SCHEMBL9303746

SCHEMBL9303746

Cc1nc2ccccc2n1Cc1ccc(S(=O)(=O)NC2CCCCC2)cc1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 2/20 0.67
TNF P01375 1/20 0.53
GALR3 O60755 2/20 0.53
NR2F2 P24468 2/20 0.53
RAB9A P51151 1/20 0.53
GSK3B P49841 1/20 0.53
HDAC1 Q13547 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
ALDH1A1 P00352 3/20 0.51
CYP3A4 P08684 1/20 0.50
TSHR P16473 1/20 0.50
HRH3 Q9Y5N1 3/20 0.48
KDM4E B2RXH2 2/20 0.47
RECQL P46063 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
POLB P06746 1/20 0.47
PPARG P37231 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
SCHEMBL9302291 0.88 PTAFR (0.55) PTAFRTNFGALR3NR2F2RAB9A
SCHEMBL8581273 0.87 PTAFR (0.57) PTAFRALDH1A1CYP3A4TSHRKDM4E
SCHEMBL9303763 0.81 PTAFR (0.55) PTAFRTNFGALR3NR2F2RAB9A
SCHEMBL9303050 0.81 PTAFR (0.59) PTAFRTNFGALR3NR2F2RAB9A
SCHEMBL9302509 0.81 PTAFR (0.83) PTAFRTNFGALR3NR2F2RAB9A
SCHEMBL9302155 0.80 PTAFR (0.58) PTAFRTNFGALR3NR2F2RAB9A
SCHEMBL9302834 0.80 PTAFR (1.00) PTAFRTNFGALR3NR2F2RAB9A
SCHEMBL9303184 0.78 CYP11B1 (0.51) TNFRAB9AHDAC1HDAC6ALDH1A1
SCHEMBL9302266 0.78 PTAFR (0.55) PTAFRTNFGALR3NR2F2RAB9A
SCHEMBL9298869 0.77 TNF (0.61) PTAFRTNFGALR3NR2F2RAB9A

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