SCHEMBL29620892

SCHEMBL29620892

N#Cc1ncccc1Nc1ncc(-c2ccc(C(F)(F)F)cc2)o1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 10/20 0.59
▸ KDR P35968 4/20 0.52
▸ FLT1 P17948 3/20 0.52
▸ FLT4 P35916 3/20 0.52
▸ P2RY1 P47900 1/20 0.45
▸ KIT P10721 4/20 0.42
▸ NPC1 O15118 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
SCHEMBL29620916 0.79 TRPV1 (0.58) TRPV1KDRFLT1FLT4P2RY1
SCHEMBL31013395 0.78 TRPV1 (0.58) TRPV1KDRFLT1FLT4P2RY1
SCHEMBL29420827 0.78 EPHX2 (0.49) TRPV1KDRFLT1P2RY1
SCHEMBL22931778 0.78 EPHX2 (0.49) TRPV1KDRFLT1P2RY1
SCHEMBL31013391 0.77 TRPV1 (0.56) TRPV1KDRFLT1FLT4P2RY1
SCHEMBL29620882 0.77 TRPV1 (0.57) TRPV1KDRFLT1FLT4P2RY1
SCHEMBL24636894 0.76 TRPV1 (0.49) TRPV1KDRFLT1FLT4KIT
SCHEMBL22925859 0.76 TRPV1 (0.49) TRPV1KDRFLT1FLT4
SCHEMBL29621008 0.76 TRPV1 (0.56) TRPV1KDRP2RY1KIT
SCHEMBL22926090 0.75 TRPV1 (0.48) TRPV1KDRFLT1FLT4KIT

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 disclosed
CN-114450281-A Inhibitor compounds 辛塞拉治疗私人有限公司 2022-05-06 — — CN disclosed
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