SCHEMBL5322958

SCHEMBL5322958

CS(=O)(=O)Nc1ccc(CC(Oc2ccc3c(c2)CCC3)C(N)=O)cc1F

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.44
TRPV1 Q8NER1 2/20 0.41
SCN9A Q15858 2/20 0.40
PPARD Q03181 1/20 0.40
PPARA Q07869 1/20 0.40

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
SCHEMBL5281260 0.77 SMN1; SMN2 (0.64) TRPV1
SCHEMBL5223625 0.75 TRPV1 (0.38) TRPV1
SCHEMBL5486486 0.74 TRPV1 (0.53) TRPV1
SCHEMBL5274596 0.70 TRPV1 (0.52) TRPV1
SCHEMBL3633978 0.70 TRPV1 (0.51) TRPV1
SCHEMBL303202 0.69 TRPV1 (0.50) TRPV1
SCHEMBL5354441 0.69 TRPV1 (0.47) TRPV1
SCHEMBL5345312 0.68 TRPV1 (0.43) TRPV1
SCHEMBL1379944 0.68
SCHEMBL5676140 0.68 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-2007120012-A1 NOVEL COMPOUNDS, ISOMER THEREOF, OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF AS VANILLOID RECEPTOR ANTAGONIST; AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AMOREPACIFIC CORPORATION (KR) 2007-10-25 WO disclosed