SCHEMBL17033725

SCHEMBL17033725

c1ccc(-c2ccc3c(c2)c2ccc4c(cc5c6ccccc6c6ccccc6n54)c2n3-c2cccc(-c3nc(-c4ccccc4)cc(-c4ccccc4)n3)c2)cc1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.34
KMT2A Q03164 5/20 0.34
ALDH1A1 P00352 3/20 0.34
MAPT P10636 3/20 0.34
HPGD P15428 3/20 0.34
KDM4E B2RXH2 3/20 0.34
LMNA P02545 2/20 0.34
NTSR1 P30989 1/20 0.33
PTGER4 P35408 1/20 0.32
PDE10A Q9Y233 1/20 0.32
GLA P06280 1/20 0.32
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
TSPO P30536 1/20 0.31
GAA P10253 1/20 0.31
NPY5R Q15761 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
SCHEMBL17033749 0.97 KDM4E (0.36) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL17033435 0.95 KMT2A (0.37) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL17033743 0.94 PTGER4 (0.33) MEN1KMT2AKDM4EPTGER4PDE10A
SCHEMBL17033747 0.91 KDM4E (0.38) MEN1KMT2AKDM4EPTGER4PDE10A
SCHEMBL17033727 0.91 HTR1A (0.35) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL17033448 0.91 KDM4E (0.35) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL17033459 0.88 KDM4E (0.35) MEN1KMT2AKDM4EPDE10AATM
SCHEMBL17033454 0.88 KDM4E (0.36) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL16675129 0.88 KDM4E (0.40) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL17033771 0.88 KDM4E (0.31) 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