SCHEMBL22925646

SCHEMBL22925646

Cc1ccc(Nc2ncc(-c3ccc(F)c(F)c3)o2)cn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.54
▸ VCP P55072 7/20 0.46
▸ KDR P35968 7/20 0.45
▸ FLT1 P17948 6/20 0.45
▸ FLT4 P35916 5/20 0.45
▸ KCNQ3 O43525 1/20 0.45
▸ KCNQ2 O43526 1/20 0.45
▸ PRKAB2 O43741 1/20 0.43
▸ LCK P06239 1/20 0.43
▸ SRC P12931 1/20 0.43
▸ FLT3 P36888 1/20 0.43
▸ PRKAG1 P54619 1/20 0.43
▸ PRKAA2 P54646 1/20 0.43
▸ PRKAA1 Q13131 1/20 0.43
▸ RPS6KA1 Q15418 1/20 0.43
▸ MKNK1 Q9BUB5 1/20 0.43
▸ PRKAG3 Q9UGI9 1/20 0.43
▸ PRKAG2 Q9UGJ0 1/20 0.43
▸ PRKAB1 Q9Y478 1/20 0.43
▸ SIRT7 Q9NRC8 1/20 0.43

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
SCHEMBL22925625 0.87 ALOX5 (0.66) ALOX5VCPKDRFLT1FLT4
SCHEMBL29620955 0.81 VCP (0.50) ALOX5VCPKDRFLT1FLT4
SCHEMBL22925943 0.81 VCP (0.50) ALOX5VCPKDRFLT1FLT4
SCHEMBL22925953 0.80 ALOX5 (0.47) ALOX5VCPKDRFLT1FLT4
SCHEMBL29696271 0.80 ALOX5 (0.47) ALOX5VCPKDRFLT1FLT4
SCHEMBL22925621 0.80 ALOX5 (0.51) ALOX5VCPKDRFLT1FLT4
SCHEMBL29620865 0.72 VCP (0.40) ALOX5VCPKDRFLT1PRKAB2
SCHEMBL28733697 0.72 VCP (0.40) ALOX5VCPKDRFLT1PRKAB2
SCHEMBL22925593 0.72 ALOX5 (0.43) ALOX5VCPKDRFLT1FLT4
SCHEMBL14438058 0.70 PTGS2 (0.51) KCNQ3KCNQ2

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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