SCHEMBL12166104

SCHEMBL12166104

Bc1ccc(OC(C)=O)c(C(=O)Nc2cc(-c3ccccc3)ccc2C=O)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFD P00746 1/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
POLB P06746 2/20 0.42
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 2/20 0.42
MAPT P10636 2/20 0.42
ACLY P53396 3/20 0.41
TOP1 P11387 2/20 0.40
HDAC8 Q9BY41 3/20 0.40
LMNA P02545 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HDAC1 Q13547 4/20 0.39
HDAC6 Q9UBN7 2/20 0.39
ABCB1 P08183 1/20 0.39
NR1H4 Q96RI1 1/20 0.39
HTT P42858 1/20 0.38
APOBEC3A P31941 1/20 0.38
GFER P55789 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38

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
SCHEMBL12165985 0.92 CFD (0.50) CFDMEN1KMT2APOLBKDM4E
SCHEMBL13205881 0.88 CFD (0.51) CFDMEN1KMT2APOLBKDM4E
SCHEMBL14428239 0.88 KDM4E (0.46) CFDMEN1KMT2APOLBKDM4E
SCHEMBL13206138 0.86 HDAC8 (0.45) CFDMEN1KMT2APOLBKDM4E
SCHEMBL12166018 0.84 MEN1 (0.46) MEN1KMT2APOLBKDM4EALDH1A1
SCHEMBL12166039 0.82 MAPT (0.50) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL12166011 0.81 ACLY (0.48) MEN1KMT2AKDM4EMAPTACLY
SCHEMBL13205894 0.80 CFD (0.61) CFDKDM4EALDH1A1ACLYTOP1
SCHEMBL13206302 0.76 ACLY (0.53) CFDMEN1KMT2APOLBKDM4E
SCHEMBL2570784 0.76 POLB (0.56) CFDPOLBKDM4EALDH1A1MAPT

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