SCHEMBL25836702

SCHEMBL25836702

O=c1[nH]c2cc3c(cc2c2cc4c5ccccc5n(-c5ccccc5)c4cc12)c1ccccc1n3-c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
ATM Q13315 1/20 0.50
MAT2A P31153 2/20 0.41
PARP1 P09874 4/20 0.41
ADORA3 P0DMS8 1/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
LMNA P02545 2/20 0.40
KDR P35968 1/20 0.39
PDE7A Q13946 1/20 0.38
PDE7B Q9NP56 1/20 0.38
SRC P12931 1/20 0.38
JAK2 O60674 1/20 0.38
JAK3 P52333 1/20 0.38
CASP7 P55210 1/20 0.38
CASP6 P55212 1/20 0.38
CASP8 Q14790 1/20 0.38
MAPK8 P45983 1/20 0.37
ALDH1A1 P00352 2/20 0.37

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
SCHEMBL25836442 0.97 KDM4E (0.50) KDM4EL3MBTL1ATMMAT2APARP1
SCHEMBL25836795 0.94 L3MBTL1 (0.44) KDM4EL3MBTL1ATMMAT2APARP1
SCHEMBL25837027 0.94 L3MBTL1 (0.44) KDM4EL3MBTL1ATMMAT2APARP1
SCHEMBL25836579 0.92 KDM4E (0.45) KDM4EL3MBTL1ATMMAT2APARP1
SCHEMBL25836701 0.92 ATM (0.42) KDM4EL3MBTL1ATMMAT2APARP1
SCHEMBL25829741 0.92 L3MBTL1 (0.42) KDM4EL3MBTL1ATMMAT2APARP1
SCHEMBL25836789 0.90 ATM (0.40) KDM4EL3MBTL1ATMMAT2APARP1
SCHEMBL21375347 0.87 L3MBTL1 (0.62) KDM4EL3MBTL1ATMMAT2AKMT2A
SCHEMBL25836925 0.87 KDM4E (0.38) KDM4EL3MBTL1ATMMAT2APARP1
SCHEMBL25837156 0.83 L3MBTL1 (0.44) KDM4EL3MBTL1ATMMAT2APARP1

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