SCHEMBL13809387

SCHEMBL13809387

CC(=O)N(Cc1cc(C)cc(C)c1)c1ccc(-c2ccc(OC(F)(F)F)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 6/20 0.58
TSPO P30536 5/20 0.53
PTGER4 P35408 1/20 0.46
SCN10A Q9Y5Y9 6/20 0.45
NR1H4 Q96RI1 1/20 0.45
GRIN2B Q13224 1/20 0.44

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
SCHEMBL1242182 0.88 SERPINE1 (0.76) SERPINE1PTGER4SCN10ANR1H4GRIN2B
SCHEMBL1241464 0.87 SERPINE1 (0.74) SERPINE1PTGER4SCN10ANR1H4GRIN2B
SCHEMBL1242241 0.86 SERPINE1 (0.60) SERPINE1PTGER4SCN10ANR1H4GRIN2B
SCHEMBL1241466 0.86 SERPINE1 (0.60) SERPINE1TSPOPTGER4SCN10ANR1H4
SCHEMBL4004791 0.78 SERPINE1 (0.77) SERPINE1PTGER4NR1H4
SCHEMBL1242160 0.78 SERPINE1 (0.76) SERPINE1PTGER4NR1H4
SCHEMBL1241371 0.77 SERPINE1 (0.80) SERPINE1NR1H4
SCHEMBL1242152 0.77 SERPINE1 (0.62) SERPINE1PTGER4SCN10ANR1H4
SCHEMBL1242162 0.77 SERPINE1 (0.62) SERPINE1PTGER4NR1H4
SCHEMBL1241514 0.75 SERPINE1 (0.63) SERPINE1SCN10ANR1H4

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-2072498-A1 N-PHENYLOXAMIDIC ACID DERIVATIVE Institute of Medicinal Molecular Design, Inc. (JP) 2009-06-24 EP disclosed