SCHEMBL25828639

SCHEMBL25828639

O=c1c2c(ccc3c4ccccc4n(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c32)c2ccc3c(c4ccccc4n3-c3ccccc3)c2n1-c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38
RAB9A P51151 1/20 0.38
HKDC1 Q2TB90 1/20 0.37
RXFP1 Q9HBX9 2/20 0.36
ALDH1A1 P00352 3/20 0.35
JAK2 O60674 1/20 0.34
JAK3 P52333 1/20 0.34
POLB P06746 1/20 0.34
TSHR P16473 1/20 0.34
BRCA1 P38398 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MAPK8 P45983 2/20 0.33
DRD1 P21728 2/20 0.33
DRD5 P21918 2/20 0.33

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
SCHEMBL25828637 0.96 KMT2A (0.41) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL30019599 0.92 L3MBTL1 (0.47) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL2754624 0.92 L3MBTL1 (0.47) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL24597939 0.91 KMT2A (0.41) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL24993933 0.91 L3MBTL1 (0.46) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL18593797 0.90 L3MBTL1 (0.45) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL17189507 0.90 L3MBTL1 (0.45) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL24550378 0.90 L3MBTL1 (0.45) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL21365848 0.90 L3MBTL1 (0.45) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL14212989 0.90 L3MBTL1 (0.45) KDM4EATML3MBTL1KMT2AMEN1

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