SCHEMBL15517657

SCHEMBL15517657

CSc1nc2c(c(NC(Cl)c3ccccc3Cl)n1)CCN(c1ncccc1C(F)(F)F)CC2

nearest known ligand 0.63

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 16/20 0.63

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
SCHEMBL4347634 0.80 TRPV1 (0.67) TRPV1
SCHEMBL5632948 0.79 TRPV1 (0.85) TRPV1
SCHEMBL4200069 0.79 TRPV1 (0.77) TRPV1
SCHEMBL4192626 0.78 TRPV1 (1.00) TRPV1
SCHEMBL4348270 0.77 TRPV1 (0.67) TRPV1
SCHEMBL5632131 0.76 TRPV1 (1.00) TRPV1
SCHEMBL4197703 0.76 TRPV1 (0.79) TRPV1
SCHEMBL4347247 0.76 TRPV1 (0.79) TRPV1
SCHEMBL5632893 0.75 TRPV1 (1.00) TRPV1
SCHEMBL5632582 0.72 TRPV1 (0.85) TRPV1

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
US-8673895-B2 Tetrahydro-pyrimidoazepines as modulators of TRPV1 JANSSEN PHARMACEUTICA NV (BE) 2014-03-18 US disclosed