SCHEMBL17033455

SCHEMBL17033455

c1ccc(-c2cccc(-n3c4ccccc4c4cc5c(cc43)cc3c4ccccc4c4ccccc4n53)n2)cc1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
KDM4E B2RXH2 3/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
COMT P21964 1/20 0.34
ASIC3 Q9UHC3 1/20 0.33
NPY5R Q15761 1/20 0.32
PARP1 P09874 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
USP30 Q70CQ3 2/20 0.31
POLB P06746 1/20 0.31
CNR1 P21554 1/20 0.31
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
ACHE P22303 1/20 0.30

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
SCHEMBL17033484 0.93 MKNK1 (0.37) RAB9AKMT2AKDM4ENPY5RPOLB
SCHEMBL16066225 0.93 KMT2A (0.37) MEN1RAB9AKMT2AKDM4ETSHR
SCHEMBL16066464 0.90 MEN1 (0.35) MEN1RAB9AKMT2AKDM4ETSHR
SCHEMBL16067219 0.90 MEN1 (0.35) MEN1RAB9AKMT2AKDM4ETSHR
SCHEMBL10027563 0.89 MEN1 (0.46) MEN1RAB9AKMT2AKDM4ETSHR
SCHEMBL16066963 0.89 KMT2A (0.36) MEN1RAB9AKMT2AKDM4ETSHR
SCHEMBL17033524 0.89 CYP2A6 (0.39)
SCHEMBL16302967 0.88 MEN1 (0.42) MEN1RAB9AKMT2AKDM4ETSHR
SCHEMBL17033490 0.88 KDM4E (0.34) KDM4EHSD17B10NPY5RATML3MBTL1
SCHEMBL10060914 0.87 MEN1 (0.47) MEN1RAB9AKMT2AKDM4ETSHR

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
WO-2015125986-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-08-27 WO disclosed