SCHEMBL6562709

SCHEMBL6562709

CC(C)(C)c1ccc(CNC(=NCc2ccc(NS(C)(=O)=O)cc2)NC#N)cc1

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.60
EPHX2 P34913 1/20 0.58
NR1H4 Q96RI1 1/20 0.58

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
SCHEMBL4892411 0.83 TRPV1 (0.66) TRPV1EPHX2NR1H4
SCHEMBL4892408 0.83 TRPV1 (0.66) TRPV1EPHX2NR1H4
SCHEMBL12567953 0.76 EPHX2 (0.80) TRPV1EPHX2NR1H4
SCHEMBL1268701 0.75 TRPV1 (1.00) TRPV1
SCHEMBL12619647 0.74 EPHX2 (1.00) TRPV1EPHX2NR1H4
SCHEMBL5827254 0.73 EPHX2 (0.74) TRPV1EPHX2NR1H4
SCHEMBL5947360 0.73 EPHX2 (0.74) TRPV1EPHX2NR1H4
SCHEMBL4890382 0.73 EPHX2 (0.53) TRPV1EPHX2NR1H4
SCHEMBL4890385 0.73 EPHX2 (0.53) TRPV1EPHX2NR1H4
SCHEMBL7131937 0.72 TRPV1 (0.60) TRPV1EPHX2NR1H4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1303483-A4 NOVEL THIOUREA DERIVATIVES AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME PACIFIC CORP (KR) 2004-11-03 EP claimed
EP-1303483-A1 NOVEL THIOUREA DERIVATIVES AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME PACIFIC CORPORATION (KR) 2003-04-23 EP claimed
WO-2002016318-A1 NOVEL THIOUREA DERIVATIVES AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME PACIFIC CORPORATION (KR) 2002-02-28 WO claimed
EP-1303483-A4 NOVEL THIOUREA DERIVATIVES AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME PACIFIC CORP (KR) 2004-11-03 EP disclosed
EP-1303483-A1 NOVEL THIOUREA DERIVATIVES AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME PACIFIC CORPORATION (KR) 2003-04-23 EP disclosed
WO-2002016318-A1 NOVEL THIOUREA DERIVATIVES AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME PACIFIC CORPORATION (KR) 2002-02-28 WO disclosed