SCHEMBL6561391

SCHEMBL6561391

CN(CCc1ccc(S(C)(=O)=O)cc1)C(=S)NCc1ccc(C(C)(C)C)cc1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.59
NR1H4 Q96RI1 2/20 0.59
TRPV1 Q8NER1 1/20 0.49
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46

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
SCHEMBL4891719 0.81 EPHX2 (0.72) EPHX2NR1H4TRPV1
SCHEMBL6563007 0.80 EPHX2 (0.63) EPHX2NR1H4TRPV1
SCHEMBL4625376 0.80 EPHX2 (0.57) EPHX2NR1H4TRPV1CA1CA2
SCHEMBL22059471 0.75 EPHX2 (1.00) EPHX2NR1H4CA1CA2
SCHEMBL4624020 0.72 EPHX2 (0.59) EPHX2NR1H4TRPV1
Hydrochloric Acid SCHEMBL5803678 0.71 EPHX2 (0.61) EPHX2NR1H4CA1CA2
SCHEMBL4891046 0.70 CA1 (0.73) EPHX2NR1H4TRPV1CA1CA2
SCHEMBL4890410 0.69 CA1 (0.69) EPHX2NR1H4TRPV1CA1CA2
SCHEMBL1107981 0.68 ALDH1A1 (0.64) EPHX2NR1H4CA1CA2
SCHEMBL4623706 0.68 TRPV1 (0.66) 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 3 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 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