SCHEMBL13740306

SCHEMBL13740306

Cc1cc(C)c(N=C=O)c(CN=C=O)c1C

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.35
GABRB2 P47870 1/20 0.35
CYP3A4 P08684 2/20 0.33
TRPA1 O75762 1/20 0.33

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
SCHEMBL21569372 0.85 PGK1 (0.33) CYP3A4TRPA1
SCHEMBL1869910 0.77 CYP3A4 (0.40) GABRA1GABRB2CYP3A4TRPA1
SCHEMBL427584 0.77 PGK1 (0.42) CYP3A4TRPA1
SCHEMBL16707385 0.77 CYP3A4 (0.40) GABRA1GABRB2CYP3A4TRPA1
SCHEMBL441816 0.76 CYP3A4 (0.43) GABRA1GABRB2CYP3A4TRPA1
SCHEMBL5427471 0.76 CYP3A4 (0.43) GABRA1GABRB2CYP3A4TRPA1
SCHEMBL28258615 0.74 GABRA1 (0.41) GABRA1GABRB2CYP3A4TRPA1
SCHEMBL4306324 0.74 CYP3A4 (0.43) GABRA1GABRB2CYP3A4TRPA1
SCHEMBL2067757 0.74 GABRA1 (0.38) GABRA1GABRB2CYP3A4TRPA1
SCHEMBL28260132 0.73 GABRA1 (0.40) GABRA1GABRB2CYP3A4TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2707219-A2 COMPOSITE INSULATING FILM Elantas Pdg, Inc. (US) 2014-03-19 EP disclosed
WO-2012155060-A2 COMPOSITE INSULATING FILM ELANTAS PDG, INC. (US) 2012-11-15 WO disclosed