SCHEMBL12166013

SCHEMBL12166013

O=Cc1ccc(-c2ccccc2)cc1NC(=O)c1ccc(Cl)cc1O

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACLY P53396 8/20 0.53
KCNMA1 Q12791 2/20 0.49
HDAC1 Q13547 3/20 0.48
SERPINE1 P05121 2/20 0.48
GRIK1 P39086 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
KDM4E B2RXH2 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
HDAC2 Q92769 1/20 0.47
SUCNR1 Q9BXA5 1/20 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
SCHEMBL1317521 0.88 ACLY (0.68) ACLYKCNMA1SERPINE1GRIK1SUCNR1
SCHEMBL12121824 0.84 HDAC1 (0.46) ACLYKCNMA1HDAC1MEN1KMT2A
SCHEMBL12165987 0.84 HDAC1 (0.56) ACLYKCNMA1HDAC1KDM4EHDAC2
SCHEMBL12166011 0.82 ACLY (0.48) ACLYKCNMA1SERPINE1GRIK1MEN1
SCHEMBL1315511 0.80 ACLY (0.50) ACLYKCNMA1HDAC1SERPINE1GRIK1
SCHEMBL12166119 0.79 HDAC1 (0.42) ACLYKCNMA1HDAC1NPSR1RXFP1
SCHEMBL1315890 0.79 ACLY (0.67) ACLYKCNMA1HDAC1SERPINE1GRIK1
SCHEMBL14429560 0.79 HTT (0.55) ACLYHDAC1KDM4EHDAC2
SCHEMBL12166105 0.79 HDAC1 (0.51) ACLYKCNMA1HDAC1KDM4EHDAC2
SCHEMBL1320352 0.78 ACMSD (0.68) ACLYKCNMA1HDAC1MEN1KMT2A

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-2385036-A1 N-ACYL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF Toyama Chemical Co., Ltd. (JP) 2011-11-09 EP disclosed