SCHEMBL15655147

SCHEMBL15655147

O=C(O)c1ccc(Nc2nc(N3CCCCC3)nc3c2CCN(c2ncccc2C(F)(F)F)CC3)cc1F

nearest known ligand 0.85

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 20/20 0.85

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
SCHEMBL4195772 0.92 TRPV1 (0.73) TRPV1
SCHEMBL4200176 0.92 TRPV1 (1.00) TRPV1
SCHEMBL15673997 0.90 TRPV1 (0.69) TRPV1
SCHEMBL5633485 0.90 TRPV1 (1.00) TRPV1
SCHEMBL4200113 0.88 TRPV1 (0.74) TRPV1
SCHEMBL4193473 0.88 TRPV1 (0.86) TRPV1
SCHEMBL4190779 0.87 TRPV1 (0.88) TRPV1
SCHEMBL4523061 0.86 TRPV1 (0.81) TRPV1
Trifluoroacetic Acid SCHEMBL5634336 0.85 TRPV1 (0.89) TRPV1
SCHEMBL4195386 0.84 TRPV1 (0.86) 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