SCHEMBL29696334

SCHEMBL29696334

COC(=O)c1ccc(Nc2ncc(-c3ccc(C(F)(F)F)c(F)c3)o2)cn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.43
▸ NOTUM Q6P988 1/20 0.42
▸ VCP P55072 5/20 0.41
▸ FLT1 P17948 5/20 0.40
▸ KDR P35968 5/20 0.40
▸ FLT4 P35916 4/20 0.40
▸ FLT3 P36888 2/20 0.39
▸ PRKAB2 O43741 1/20 0.39
▸ LCK P06239 1/20 0.39
▸ SRC P12931 1/20 0.39
▸ PRKAG1 P54619 1/20 0.39
▸ PRKAA2 P54646 1/20 0.39
▸ PRKAA1 Q13131 1/20 0.39
▸ RPS6KA1 Q15418 1/20 0.39
▸ MKNK1 Q9BUB5 1/20 0.39
▸ PRKAG3 Q9UGI9 1/20 0.39
▸ PRKAG2 Q9UGJ0 1/20 0.39
▸ PRKAB1 Q9Y478 1/20 0.39
▸ KCNQ3 O43525 1/20 0.38
▸ KCNQ2 O43526 1/20 0.38

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
SCHEMBL22925869 1.00 ALOX5 (0.43) ALOX5NOTUMVCPFLT1KDR
SCHEMBL22925871 0.89 VCP (0.46) ALOX5VCPFLT1KDRFLT4
SCHEMBL29620878 0.89 VCP (0.46) ALOX5VCPFLT1KDRFLT4
SCHEMBL22925953 0.89 ALOX5 (0.47) ALOX5VCPFLT1KDRFLT4
SCHEMBL29696271 0.89 ALOX5 (0.47) ALOX5VCPFLT1KDRFLT4
SCHEMBL29620863 0.88 FLT3 (0.46) ALOX5VCPFLT1KDRFLT3
SCHEMBL28733808 0.88 FLT3 (0.46) ALOX5VCPFLT1KDRFLT3
SCHEMBL22925600 0.85 TRPV1 (0.45) ALOX5VCPFLT1KDRFLT4
SCHEMBL22926098 0.84 ALOX5 (0.57) ALOX5VCPFLT1KDRFLT4
SCHEMBL29696302 0.84 ALOX5 (0.57) ALOX5VCPFLT1KDRFLT4

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
EP-4003986-A1 INHIBITOR COMPOUNDS Cincera Therapeutics Pty Ltd (AU) 2022-06-01 — — EP disclosed
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