SCHEMBL11512059

SCHEMBL11512059

Oc1ccc(NCc2ccccc2)c(O)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.62
MAPT P10636 5/20 0.62
KMT2A Q03164 5/20 0.62
KDM4E B2RXH2 4/20 0.62
THRB P10828 3/20 0.62
ALDH1A1 P00352 2/20 0.62
ALOX12 P18054 1/20 0.62
IDO1 P14902 2/20 0.59
ALOX5 P09917 2/20 0.50
HSD17B10 Q99714 2/20 0.47
GAA P10253 3/20 0.44
BLM P54132 2/20 0.44
TP53 P04637 1/20 0.44
ATM Q13315 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
SYK P43405 2/20 0.43
ASPH Q12797 1/20 0.42
RIOX2 Q8IUF8 1/20 0.42

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
SCHEMBL11513224 0.85 KDM4E (0.68) MEN1MAPTKMT2AKDM4ETHRB
SCHEMBL9750717 0.84 IDO1 (0.61) MEN1MAPTKMT2AKDM4ETHRB
SCHEMBL4342011 0.83 KDM4E (0.52) MEN1MAPTKMT2AKDM4ETHRB
SCHEMBL4347717 0.82 MEN1 (0.69) MEN1MAPTKMT2AKDM4ETHRB
SCHEMBL6130238 0.82 IDO1 (0.56) MEN1MAPTKMT2AKDM4ETHRB
SCHEMBL4348993 0.82 MAPT (0.46) MEN1MAPTKMT2AKDM4ETHRB
SCHEMBL11510707 0.81 IDO1 (0.49) MEN1MAPTKMT2AKDM4ETHRB
SCHEMBL268673 0.80 KDM4E (0.78) MEN1MAPTKMT2AKDM4ETHRB
SCHEMBL4347345 0.79 GAA (0.67) MEN1MAPTKMT2AKDM4ETHRB
SCHEMBL11026552 0.79 HDAC1 (0.60) MEN1MAPTKMT2AKDM4ETHRB

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
US-4152452-A N-BENZYLANILINE AND DERIVATIVES WILLIAM H. RORER, INC. (US) 1979-05-01 US disclosed