SCHEMBL15655385

SCHEMBL15655385

CCCc1nc2c(c(Nc3ccc(S(=O)(=O)N4CCCC4)cc3)n1)CCN(c1ncccc1C(F)(F)F)CC2

nearest known ligand 0.76

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 19/20 0.76

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
SCHEMBL5633896 0.86 TRPV1 (1.00) TRPV1
SCHEMBL4182334 0.83 TRPV1 (0.78) TRPV1
SCHEMBL5634049 0.82 TRPV1 (1.00) TRPV1
SCHEMBL4337411 0.82 TRPV1 (1.00) TRPV1
SCHEMBL4188369 0.81 TRPV1 (0.78) TRPV1
SCHEMBL4184962 0.81 TRPV1 (0.78) TRPV1
SCHEMBL4333256 0.81 TRPV1 (1.00) TRPV1
SCHEMBL4346951 0.80 TRPV1 (0.88) TRPV1
SCHEMBL4193246 0.80 TRPV1 (0.81) TRPV1
SCHEMBL5633380 0.80 TRPV1 (1.00) 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
EP-2024368-B1 6,7,8,9-TETRAHYDRO-5H-PYRIMIDO[4,5-D]AZEPIN-4-YL]-AMINE DERIVATIVES AS MODULATORS OF TRPV1 FOR THE TREATMENT OF PAIN JANSSEN PHARMACEUTICA NV (BE) 2014-04-30 EP claimed