SCHEMBL22925895

SCHEMBL22925895

Cc1cc(Nc2ncc(-c3ccc(C(F)(F)F)cc3)o2)cnc1C

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.58
▸ TRPV1 Q8NER1 9/20 0.49
▸ KIT P10721 3/20 0.48
▸ KDR P35968 5/20 0.46
▸ FLT1 P17948 4/20 0.46
▸ FLT4 P35916 4/20 0.46
▸ VCP P55072 1/20 0.41
▸ SIRT7 Q9NRC8 1/20 0.41

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
SCHEMBL24637048 0.84 ALOX5 (0.55) ALOX5TRPV1KITKDRFLT1
SCHEMBL22925577 0.82 ALOX5 (0.53) ALOX5TRPV1KITKDRFLT1
SCHEMBL22925621 0.82 ALOX5 (0.51) ALOX5TRPV1KITKDRFLT1
SCHEMBL26307279 0.82 FLT1 (0.52) ALOX5TRPV1KDRFLT1FLT4
SCHEMBL22925990 0.81 ALOX5 (0.51) ALOX5TRPV1KITKDRFLT1
SCHEMBL14134241 0.81 KDR (0.73) ALOX5TRPV1KITKDRFLT1
SCHEMBL29620925 0.78 TRPV1 (0.48) ALOX5TRPV1KITKDRFLT1
SCHEMBL22925553 0.78 TRPV1 (0.49) ALOX5TRPV1KDRFLT1FLT4
SCHEMBL22925652 0.78 TRPV1 (0.50) ALOX5TRPV1KDRFLT1FLT4
SCHEMBL23540014 0.77 VCP (0.69) ALOX5TRPV1KDRFLT1FLT4

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-2021012018-A1 INHIBITOR COMPOUNDS Cincera Therapeutics Pty Ltd (AU) 2021-01-28 — — WO disclosed
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