SCHEMBL10474692

SCHEMBL10474692

Cc1nc2ccccc2n1Cc1cc(S(=O)(=O)N(C)Cc2ccccc2)cc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 1/20 0.50
TNF P01375 1/20 0.49
GALR3 O60755 3/20 0.45
NR2F2 P24468 3/20 0.45
RAB9A P51151 2/20 0.45
NPC1 O15118 1/20 0.45
KDM4E B2RXH2 3/20 0.41
TSHR P16473 2/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
PKM P14618 1/20 0.41
MAPK1 P28482 1/20 0.41
POLB P06746 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
GSK3B P49841 1/20 0.40
CXCR4 P61073 1/20 0.40

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
SCHEMBL9302639 0.82 PTAFR (0.64) PTAFRTNFGALR3NR2F2RAB9A
SCHEMBL9302593 0.81 PTAFR (0.62) PTAFRTNFGALR3NR2F2RAB9A
SCHEMBL9302637 0.81 PTAFR (0.57) PTAFRTNFGALR3NR2F2RAB9A
SCHEMBL9302294 0.76 GALR3 (0.67) PTAFRTNFGALR3NR2F2RAB9A
SCHEMBL9302731 0.76 GALR3 (0.68) PTAFRTNFGALR3NR2F2RAB9A
SCHEMBL9303024 0.75 PTAFR (0.58) PTAFRTNFGALR3NR2F2RAB9A
SCHEMBL9303788 0.70 TNF (0.61) PTAFRTNFGALR3NR2F2RAB9A
SCHEMBL231295 0.69 TNF (1.00) TNFGALR3NR2F2RAB9ANPC1
SCHEMBL9302841 0.69 CNR2 (0.59) PTAFRTNFGALR3NR2F2RAB9A
SCHEMBL9302023 0.68 PTAFR (0.66) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

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