SCHEMBL4447940

SCHEMBL4447940

O=C(/C=C1\CCCOc2cc(C(F)(F)F)ccc21)Nc1ccc2c(c1)NS(O)(O)CC2

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 18/20 0.44
CSNK1A1 P48729 1/20 0.34
CRBN Q96SW2 1/20 0.34
IKZF2 Q9UKS7 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34

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
SCHEMBL3590379 0.92 TRPV1 (0.43) TRPV1CSNK1A1CRBNIKZF2MEN1
SCHEMBL3590382 0.92 TRPV1 (0.43) TRPV1CSNK1A1CRBNIKZF2MEN1
SCHEMBL3590842 0.87 TRPV1 (0.41) TRPV1CSNK1A1CRBNIKZF2MEN1
SCHEMBL3590846 0.87 TRPV1 (0.41) TRPV1CSNK1A1CRBNIKZF2MEN1
SCHEMBL1450532 0.86 TRPV1 (0.49) TRPV1CSNK1A1CRBNIKZF2
SCHEMBL1450537 0.86 TRPV1 (0.49) TRPV1CSNK1A1CRBNIKZF2
SCHEMBL1450825 0.86 TRPV1 (0.59) TRPV1CSNK1A1CRBNIKZF2
SCHEMBL1451875 0.84 TRPV1 (0.52) TRPV1CSNK1A1CRBNIKZF2
SCHEMBL1451871 0.84 TRPV1 (0.52) TRPV1CSNK1A1CRBNIKZF2
SCHEMBL1450631 0.83 TRPV1 (0.47) TRPV1MEN1KMT2ARXFP1

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-2128157-A1 HETEROCYCLIDENE-N-(ARYL)ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2009-12-02 EP disclosed