SCHEMBL4996374

SCHEMBL4996374

Cc1cc(C)c(C(N=C=O)N=C=O)cc1C(N=C=O)N=C=O

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.31
CYP3A4 P08684 1/20 0.31

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
SCHEMBL9276569 0.93 TRPA1 (0.31) TRPA1CYP3A4
SCHEMBL732549 0.80 TRPA1 (0.31) TRPA1CYP3A4
SCHEMBL58375 0.79 TP53 (0.34) TRPA1CYP3A4
SCHEMBL3182837 0.77 CYP3A4 (0.31) TRPA1CYP3A4
SCHEMBL2522117 0.76 CYP3A4 (0.31) TRPA1CYP3A4
SCHEMBL163750 0.74 ESR1 (0.43) CYP3A4
SCHEMBL5710754 0.72 CYP3A4 (0.32) TRPA1CYP3A4
SCHEMBL11682593 0.71 TRPA1 (0.33) TRPA1CYP3A4
SCHEMBL9476215 0.71 RAPGEF4 (0.31) TRPA1CYP3A4
SCHEMBL27510474 0.71 CYP3A4 (0.39) TRPA1CYP3A4

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2059546-B2 SAGGING CONTROL AGENTS COATINGS FOREIGN IP CO LLC (US) 2018-09-19 EP disclosed
EP-2059548-B1 AQUEOUS COMPOSITIONS OF SAGGING CONTROL AGENTS COATINGS FOREIGN IP CO LLC (US) 2015-07-15 EP disclosed
EP-2059546-B1 SAGGING CONTROL AGENTS COATINGS FOREIGN IP CO LLC (US) 2015-03-11 EP disclosed
US-20080132638-A1 Aqueous compositions of sagging control agents E. I. DU PONT DE NEMOURS AND COMPANY 2008-06-05 US disclosed
US-20080132639-A1 Sagging control agents E. I. DU PONT DE NEMOURS AND COMPANY 2008-06-05 US disclosed