SCHEMBL20070554

SCHEMBL20070554

c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c(ccc6c5c5cccc7c8ccccc8n6c75)c43)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
ATM Q13315 2/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
MAPT P10636 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
GAA P10253 1/20 0.32
POLB P06746 1/20 0.32
HTT P42858 1/20 0.32
DUSP3 P51452 1/20 0.31

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
SCHEMBL20071688 0.94 KDM4E (0.32) KDM4ETSHRHSD17B10L3MBTL1ATM
SCHEMBL20071637 0.94 KDM4E (0.33) KDM4ETSHRHSD17B10L3MBTL1ATM
SCHEMBL21453481 0.93 KDM4E (0.32) KDM4ETSHRHSD17B10L3MBTL1ATM
SCHEMBL20071369 0.90 KDM4E (0.31) KDM4ETSHRHSD17B10L3MBTL1ATM
SCHEMBL20071636 0.89 KDM4E (0.33) KDM4ETSHRHSD17B10L3MBTL1ATM
SCHEMBL21454124 0.88 KDM4E (0.31) KDM4ETSHRHSD17B10
SCHEMBL21453488 0.88 KDM4E (0.32) KDM4ETSHRHSD17B10L3MBTL1ATM
SCHEMBL26350842 0.86 DUSP3 (0.32) DUSP3
SCHEMBL23474680 0.86 KDM4E (0.33) KDM4ETSHRHSD17B10L3MBTL1ATM
SCHEMBL20070560 0.86 ALDH1A1 (0.44) KDM4EHSD17B10L3MBTL1ATMMEN1

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-2018070836-A1 COMPOUND FOR ORGANIC ELECTRONIC DEVICE, ORGANIC ELECTRONIC DEVICE USING SAME AND ELECTRONIC APPARATUS THEREFOR 덕산네오룩스 주식회사 2018-04-19 WO disclosed