SCHEMBL2570784

SCHEMBL2570784

CC(=O)Oc1ccc(Br)cc1C(=O)Nc1cc(-c2ccccc2)ccc1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.56
CFD P00746 1/20 0.56
LMNA P02545 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
ACLY P53396 10/20 0.52
KDM4E B2RXH2 2/20 0.46
RXFP1 Q9HBX9 1/20 0.46
HDAC8 Q9BY41 1/20 0.45
TRPM2 O94759 1/20 0.45
ALDH1A1 P00352 2/20 0.45
ESR1 P03372 1/20 0.45
ITGB3 P05106 1/20 0.45
ITGA2B P08514 1/20 0.45
HMGB1 P09429 1/20 0.45
HPGD P15428 1/20 0.45
TSHR P16473 1/20 0.45
GGT1 P19440 1/20 0.45
PTGS1 P23219 1/20 0.45
PTGS2 P35354 1/20 0.45
BLM P54132 1/20 0.45

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
SCHEMBL13205894 0.93 CFD (0.61) CFDACLYKDM4EHDAC8ALDH1A1
SCHEMBL1317055 0.91 POLB (0.56) POLBCFDLMNANPSR1ACLY
SCHEMBL13206302 0.89 ACLY (0.53) POLBCFDLMNANPSR1ACLY
SCHEMBL12369705 0.88 KDM4E (0.56) CFDLMNAACLYKDM4EALDH1A1
SCHEMBL13205881 0.88 CFD (0.51) POLBCFDLMNANPSR1ACLY
SCHEMBL1316660 0.87 POLB (0.50) POLBCFDLMNANPSR1ACLY
SCHEMBL2571108 0.84 LRRK2 (0.59) POLBLMNANPSR1ACLYKDM4E
SCHEMBL1316555 0.82 ACLY (0.56) ACLYKDM4ETRPM2HDAC2
SCHEMBL13206267 0.82 ACLY (0.60) NPSR1ACLY
SCHEMBL2575383 0.81 ACLY (0.45) POLBCFDLMNANPSR1ACLY

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