SCHEMBL9200501

SCHEMBL9200501

CC(N)C(=O)NCc1ccc(O)cc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 8/20 0.56
PRMT6 Q96LA8 8/20 0.56
ERCC1 P07992 1/20 0.50
ERCC4 Q92889 1/20 0.50
TAAR1 Q96RJ0 3/20 0.48
SLC6A2 P23975 1/20 0.48
TPSAB1 Q15661 2/20 0.48
PLG P00747 1/20 0.48
PRSS1 P07477 1/20 0.48

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
SCHEMBL9199910 1.00 CARM1 (0.56) CARM1PRMT6ERCC1ERCC4TAAR1
SCHEMBL24648968 0.86 CARM1 (0.56) CARM1PRMT6ERCC1ERCC4TPSAB1
SCHEMBL30956341 0.86 MEN1 (0.59) CARM1PRMT6
SCHEMBL18887748 0.85 ERCC1 (0.67) ERCC1ERCC4TPSAB1PLGPRSS1
SCHEMBL10692282 0.84 CARM1 (0.62) CARM1PRMT6
SCHEMBL24649296 0.84 CARM1 (0.58) CARM1PRMT6
SCHEMBL20438751 0.84 CARM1 (0.66) CARM1PRMT6
SCHEMBL1790978 0.84 KMT2A (0.63) CARM1PRMT6
SCHEMBL2236118 0.84 KMT2A (0.63) CARM1PRMT6
SCHEMBL17667847 0.84 ERCC1 (0.51) ERCC1ERCC4TPSAB1PLGPRSS1

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-0680469-A1 AMINOACID DERIVATES, MEDICAMENTS CONTAINING THESE COMPOUNDS AND PROCESS FOR PREPARING THE SAME Dr. Karl Thomae GmbH (DE) 1995-11-08 EP disclosed
WO-1994017035-A1 AMINOACID DERIVATES, MEDICAMENTS CONTAINING THESE COMPOUNDS AND PROCESS FOR PREPARING THE SAME DR. KARL THOMAE GMBH (DE) 1994-08-04 WO disclosed