SCHEMBL25830604

SCHEMBL25830604

O=c1c2ccc3c(c4ccccc4n3-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2c2cc3c(cc2n1-c1ccccc1)c1ccccc1n3-c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.42
KDM4E B2RXH2 2/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 4/20 0.38
ALDH1A1 P00352 4/20 0.38
POLB P06746 1/20 0.38
TSHR P16473 1/20 0.38
BRCA1 P38398 1/20 0.38
HSD17B10 Q99714 1/20 0.38
NPC1 O15118 1/20 0.37
LMNA P02545 1/20 0.37
RAB9A P51151 1/20 0.37
JAK2 O60674 1/20 0.35
JAK3 P52333 1/20 0.35
RXFP1 Q9HBX9 2/20 0.35
CYP1A2 P05177 1/20 0.34
GLA P06280 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34

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
SCHEMBL25830508 0.88 KDM4E (0.50) KMT2AKDM4EATML3MBTL1MEN1
SCHEMBL25830682 0.87 KMT2A (0.44) KMT2AKDM4EATML3MBTL1MEN1
SCHEMBL14933377 0.87 KMT2A (0.44) KMT2AKDM4EATML3MBTL1MEN1
SCHEMBL12691493 0.86 L3MBTL1 (0.36) KMT2AKDM4EATML3MBTL1MEN1
SCHEMBL25829514 0.85 KMT2A (0.46) KMT2AKDM4EATML3MBTL1MEN1
SCHEMBL24800914 0.85 L3MBTL1 (0.45) KMT2AKDM4EATML3MBTL1MEN1
SCHEMBL23183740 0.85 L3MBTL1 (0.45) KMT2AKDM4EATML3MBTL1MEN1
SCHEMBL25829516 0.84 KMT2A (0.47) KMT2AKDM4EATML3MBTL1MEN1
SCHEMBL23805858 0.84 L3MBTL1 (0.46) KMT2AKDM4EATML3MBTL1MEN1
SCHEMBL23183656 0.84 L3MBTL1 (0.46) KMT2AKDM4EATML3MBTL1MEN1

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