SCHEMBL3936207

SCHEMBL3936207

O=C(O)CCCc1ccc(C(F)(F)F)nc1N1CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 17/20 0.46

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
SCHEMBL3924315 0.84 TRPV1 (0.44) TRPV1
SCHEMBL5813387 0.78 TRPV1 (0.47) TRPV1
SCHEMBL2553309 0.77 TRPV1 (0.47) TRPV1
SCHEMBL4015287 0.76 TRPV1 (0.39) TRPV1
SCHEMBL13963132 0.76 TRPV1 (0.39) TRPV1
SCHEMBL4088039 0.76 SCN10A (0.55) TRPV1
SCHEMBL2555362 0.76 TRPV1 (0.47) TRPV1
SCHEMBL1474393 0.74 SCN10A (0.53) TRPV1
SCHEMBL27965204 0.73 TRPV1 (0.62) TRPV1
SCHEMBL13676162 0.72 TRPV1 (0.49) 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
WO-2009007418-A1 NOVEL BRONCHODILATING ISOQUINOLINE AMIDES RESPIRATORIUS AB (SE) 2009-01-15 WO disclosed