SCHEMBL25837637

SCHEMBL25837637

O=c1c2cc3c(cc2c2cc4c5ccccc5n(-c5ccccc5)c4cc2n1-c1cccc(-c2ccccc2)c1)c1ccccc1n3-c1ccc(-c2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.48
KDM4E B2RXH2 2/20 0.45
ATM Q13315 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PDE10A Q9Y233 1/20 0.42
ALDH1A1 P00352 4/20 0.40
MEN1 O00255 3/20 0.40
POLB P06746 1/20 0.40
TSHR P16473 1/20 0.40
BRCA1 P38398 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MAPK1 P28482 1/20 0.40
CYP1A2 P05177 1/20 0.39
GLA P06280 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
PGR P06401 3/20 0.39
HDAC4 P56524 1/20 0.39

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
SCHEMBL25829302 0.97 KMT2A (0.50) KMT2AKDM4EATML3MBTL1PDE10A
SCHEMBL25837579 0.97 KMT2A (0.50) KMT2AKDM4EATML3MBTL1PDE10A
SCHEMBL25829197 0.97 KMT2A (0.50) KMT2AKDM4EATML3MBTL1PDE10A
SCHEMBL25829200 0.97 KMT2A (0.50) KMT2AKDM4EATML3MBTL1PDE10A
SCHEMBL25830135 0.95 KMT2A (0.52) KMT2AKDM4EATML3MBTL1PDE10A
SCHEMBL25830146 0.92 KMT2A (0.50) KMT2AKDM4EATML3MBTL1PDE10A
SCHEMBL24664194 0.90 KMT2A (0.43) KMT2AKDM4EATML3MBTL1PDE10A
SCHEMBL25829740 0.90 KDM4E (0.50) KMT2AKDM4EATML3MBTL1ALDH1A1
SCHEMBL19769401 0.89 L3MBTL1 (0.56) KMT2AKDM4EATML3MBTL1PDE10A
SCHEMBL19769379 0.89 L3MBTL1 (0.56) KMT2AKDM4EATML3MBTL1PDE10A

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-2023110742-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-06-22 WO disclosed