SCHEMBL4811896

SCHEMBL4811896

CCCS(=O)(=O)c1ccc(NC(=O)c2ccc(-c3ncccc3C(F)(F)F)cc2)nc1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 17/20 0.67
▸ CA12 O43570 1/20 0.43
▸ CA1 P00915 1/20 0.43
▸ CA9 Q16790 1/20 0.43
▸ SCN5A Q14524 1/20 0.42
▸ SCN9A Q15858 1/20 0.42
▸ DEGS1 O15121 1/20 0.41

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
SCHEMBL4815634 0.88 TRPV1 (0.69) TRPV1
SCHEMBL4815483 0.86 TRPV1 (0.51) TRPV1CA12CA1CA9DEGS1
SCHEMBL4811888 0.85 TRPV1 (0.70) TRPV1SCN5ASCN9ADEGS1
SCHEMBL15779639 0.81 TRPV1 (0.80) TRPV1
SCHEMBL4464126 0.81 TRPV1 (1.00) TRPV1DEGS1
SCHEMBL10324365 0.80 TRPV1 (0.78) TRPV1SCN5ASCN9ADEGS1
SCHEMBL14084066 0.79 TRPV1 (0.80) TRPV1SCN5ASCN9ADEGS1
SCHEMBL14252856 0.76 TRPV1 (0.76) TRPV1
SCHEMBL4811324 0.76 TRPV1 (0.68) TRPV1
SCHEMBL4811321 0.75 TRPV1 (0.75) 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-7338950-B2 Amide compounds as ion channel ligands and uses thereof RENOVIS, INC. (US) 2008-03-04 — — US disclosed
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