SCHEMBL25974139

SCHEMBL25974139

N#Cc1cc(-c2nccnc2Nc2ccc(C(F)(F)F)cc2)ccc1O

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 13/20 0.43
▸ EPHX2 P34913 3/20 0.41
▸ DHODH Q02127 2/20 0.40
▸ KIF11 P52732 1/20 0.40
▸ XDH P47989 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
SCHEMBL25974054 0.84 TRPV1 (0.44) TRPV1EPHX2DHODH
SCHEMBL25974213 0.83 TRPV1 (0.51) TRPV1EPHX2
SCHEMBL25974206 0.83 TRPV1 (0.46) TRPV1EPHX2
SCHEMBL25974211 0.82 TRPV1 (0.45) TRPV1EPHX2KIF11
SCHEMBL25340973 0.80 TRPV1 (0.43) TRPV1EPHX2
SCHEMBL30519297 0.79 KIF11 (0.50) TRPV1EPHX2KIF11
SCHEMBL25341876 0.79 KIF11 (0.50) TRPV1EPHX2KIF11
SCHEMBL25975306 0.79 EPHX2 (0.45) TRPV1EPHX2
SCHEMBL25341811 0.78 TRPV1 (0.42) TRPV1EPHX2DHODH
SCHEMBL25973974 0.77 ALDH1A1 (0.38) TRPV1KIF11XDH

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-2023146513-A1 COMPOUNDS AND METHODS OF USE THEREOF VIVACE THERAPEUTICS, INC. (US) 2023-08-03 — — WO disclosed
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