SCHEMBL22925839

SCHEMBL22925839

NC(=O)c1ccc(Nc2ncc(-c3ccc(C(F)(F)F)cc3)o2)cn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.52
▸ TRPV1 Q8NER1 8/20 0.47
▸ FLT3 P36888 3/20 0.45
▸ KIT P10721 1/20 0.45
▸ VCP P55072 3/20 0.44
▸ ALOX5 P09917 1/20 0.44
▸ FLT1 P17948 3/20 0.42
▸ KDR P35968 3/20 0.42
▸ FLT4 P35916 2/20 0.42
▸ KIF11 P52732 1/20 0.42
▸ PRKAB2 O43741 1/20 0.42
▸ LCK P06239 1/20 0.42
▸ SRC P12931 1/20 0.42
▸ PRKAG1 P54619 1/20 0.42
▸ PRKAA2 P54646 1/20 0.42
▸ PRKAA1 Q13131 1/20 0.42
▸ RPS6KA1 Q15418 1/20 0.42
▸ MKNK1 Q9BUB5 1/20 0.42
▸ PRKAG3 Q9UGI9 1/20 0.42
▸ PRKAG2 Q9UGJ0 1/20 0.42

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
SCHEMBL22925576 0.90 TRPV1 (0.47) TRPV1VCPALOX5FLT1KDR
SCHEMBL22925617 0.89 VCP (0.46) TRPV1VCPALOX5FLT1KDR
SCHEMBL22925735 0.88 VCP (0.46) TRPV1VCPALOX5FLT1KDR
SCHEMBL31013371 0.88 VCP (0.46) TRPV1VCPALOX5FLT1KDR
SCHEMBL22925600 0.87 TRPV1 (0.45) TRPV1VCPALOX5FLT1KDR
SCHEMBL22925769 0.87 TRPV1 (0.45) TRPV1FLT3VCPALOX5FLT1
SCHEMBL22925694 0.85 VCP (0.46) TRPV1VCPALOX5KDRDGAT1
SCHEMBL22925770 0.85 TRPV1 (0.46) TRPV1VCPALOX5FLT1KDR
SCHEMBL29620932 0.85 VCP (0.46) TRPV1VCPALOX5KDRDGAT1
SCHEMBL29696307 0.85 TRPV1 (0.46) TRPV1VCPALOX5FLT1KDR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114450281-B Inhibitor compounds 辛塞拉治疗私人有限公司 2024-08-16 — — CN claimed
WO-2021012018-A1 INHIBITOR COMPOUNDS Cincera Therapeutics Pty Ltd (AU) 2021-01-28 — — WO disclosed
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