SCHEMBL29620896

SCHEMBL29620896

Oc1ccnc(Nc2ncc(-c3ccc(C(F)(F)F)cc3)o2)c1O

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 9/20 0.52
▸ ALOX5 P09917 1/20 0.44
▸ VCP P55072 3/20 0.41
▸ KIT P10721 2/20 0.40
▸ HDAC1 Q13547 2/20 0.39
▸ HDAC6 Q9UBN7 2/20 0.39
▸ DGAT1 O75907 1/20 0.39
▸ KDR P35968 2/20 0.39
▸ FLT1 P17948 1/20 0.39
▸ FLT4 P35916 1/20 0.39

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
SCHEMBL29620901 0.85 TRPV1 (0.54) TRPV1ALOX5VCPKITKDR
SCHEMBL28733745 0.80 TRPV1 (0.47) TRPV1ALOX5VCPHDAC1HDAC6
SCHEMBL23540014 0.77 VCP (0.69) TRPV1ALOX5VCPKDRFLT1
SCHEMBL22925556 0.77 TRPV1 (0.55) TRPV1ALOX5VCPKITDGAT1
SCHEMBL22925673 0.75 TRPV1 (0.59) TRPV1ALOX5VCPKDRFLT1
SCHEMBL14057525 0.73 TRPV1 (0.66) TRPV1ALOX5VCPKDRFLT1
SCHEMBL26307279 0.72 FLT1 (0.52) TRPV1ALOX5VCPKDRFLT1
SCHEMBL23540651 0.72 VCP (0.69) TRPV1ALOX5VCPKDRFLT1
SCHEMBL22925566 0.71 TRPV1 (0.47) TRPV1ALOX5VCPHDAC1HDAC6
SCHEMBL22925553 0.71 TRPV1 (0.49) TRPV1ALOX5VCPHDAC1HDAC6

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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