SCHEMBL17033741

SCHEMBL17033741

c1ccc(-c2ccc3c(c2)c2ccc4c(cc5c6ccccc6c6ccccc6n54)c2n3-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSPO P30536 1/20 0.34
NPY5R Q15761 2/20 0.33
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
PTGER4 P35408 2/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
ATM Q13315 1/20 0.31
NR3C1 P04150 1/20 0.30
KDM4E B2RXH2 1/20 0.30
TSHR P16473 1/20 0.30
HSD17B10 Q99714 1/20 0.30
DNM1 Q05193 1/20 0.30
SRC P12931 1/20 0.30
PRKACA P17612 1/20 0.30
PRKACG P22612 1/20 0.30
PRKACB P22694 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
SCHEMBL17033775 0.96 MEN1 (0.33) NPY5RMEN1KMT2AALDH1A1MAPT
SCHEMBL17033444 0.94 KDM4E (0.33) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL17033437 0.92 KDM4E (0.31) MEN1KMT2AMAPTATMKDM4E
SCHEMBL17033755 0.90 TSPO (0.34) TSPONPY5RMEN1KMT2AALDH1A1
SCHEMBL17033743 0.89 PTGER4 (0.33) TSPONPY5RMEN1KMT2APTGER4
SCHEMBL17033768 0.88 NPY5R (0.37) NPY5RALDH1A1MAPTHPGDKDM4E
SCHEMBL17033438 0.88 L3MBTL1 (0.37) MEN1KMT2APTGER4ALDH1A1MAPT
SCHEMBL17033448 0.87 KDM4E (0.35) MEN1KMT2APTGER4ALDH1A1MAPT
SCHEMBL17033733 0.87 PDE10A (0.34) MEN1KMT2AMAPTATMKDM4E
SCHEMBL17033905 0.87 CYP1A1 (0.36) MEN1KMT2AALDH1A1MAPTHPGD

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