SCHEMBL25830509

SCHEMBL25830509

O=c1[nH]c2cc3c4ccccc4n(-c4ccc5c6ccccc6c6ccccc6c5c4)c3cc2c2c1ccc1c2c2ccccc2n1-c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
ATM Q13315 1/20 0.39
JAK2 O60674 1/20 0.38
JAK3 P52333 1/20 0.38
MAT2A P31153 4/20 0.37
PARP1 P09874 5/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
LMNA P02545 2/20 0.35
ADORA3 P0DMS8 1/20 0.34
KDR P35968 1/20 0.32
ALDH1A1 P00352 2/20 0.32
HSD17B10 Q99714 2/20 0.32
TNKS O95271 1/20 0.32
CYP1A2 P05177 1/20 0.32
GPR3 P46089 1/20 0.32
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32
PARP15 Q460N3 1/20 0.32

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
SCHEMBL25837156 0.90 L3MBTL1 (0.44) KDM4EL3MBTL1ATMJAK2JAK3
SCHEMBL25837027 0.85 L3MBTL1 (0.44) KDM4EL3MBTL1ATMMAT2APARP1
SCHEMBL27044633 0.82 L3MBTL1 (0.58) KDM4EL3MBTL1ATMJAK2JAK3
SCHEMBL25836442 0.81 KDM4E (0.50) KDM4EL3MBTL1ATMJAK2JAK3
SCHEMBL27044636 0.79 L3MBTL1 (0.62) KDM4EL3MBTL1ATMJAK2JAK3
SCHEMBL31337505 0.79 L3MBTL1 (0.57) KDM4EL3MBTL1ATMJAK2JAK3
SCHEMBL16076357 0.79 L3MBTL1 (0.57) KDM4EL3MBTL1ATMJAK2JAK3
SCHEMBL25829741 0.79 L3MBTL1 (0.42) KDM4EL3MBTL1ATMJAK2JAK3
SCHEMBL25836702 0.79 KDM4E (0.50) KDM4EL3MBTL1ATMJAK2JAK3
SCHEMBL25837836 0.79 L3MBTL1 (0.46) KDM4EL3MBTL1ATMJAK2JAK3

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