SCHEMBL25837156

SCHEMBL25837156

O=c1[nH]c2cc3c(cc2c2c1ccc1c2c2ccccc2n1-c1ccccc1)c1ccccc1n3-c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.44
KDM4E B2RXH2 2/20 0.44
ATM Q13315 1/20 0.44
JAK2 O60674 1/20 0.42
JAK3 P52333 1/20 0.42
MAT2A P31153 4/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 1/20 0.39
ADORA3 P0DMS8 1/20 0.37
PARP1 P09874 4/20 0.36
KDR P35968 1/20 0.35
PDE7A Q13946 1/20 0.35
PDE7B Q9NP56 1/20 0.35
ALDH1A1 P00352 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 1/20 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
SCHEMBL25830509 0.90 KDM4E (0.39) L3MBTL1KDM4EATMJAK2JAK3
SCHEMBL25837836 0.86 L3MBTL1 (0.46) L3MBTL1KDM4EATMJAK2JAK3
SCHEMBL25836702 0.83 KDM4E (0.50) L3MBTL1KDM4EATMJAK2JAK3
SCHEMBL22478945 0.82 L3MBTL1 (0.46) L3MBTL1KDM4EATMJAK2JAK3
SCHEMBL21375749 0.81 L3MBTL1 (0.47) L3MBTL1KDM4EATMJAK2JAK3
SCHEMBL25829741 0.81 L3MBTL1 (0.42) L3MBTL1KDM4EATMJAK2JAK3
SCHEMBL25836442 0.81 KDM4E (0.50) L3MBTL1KDM4EATMJAK2JAK3
SCHEMBL25837027 0.81 L3MBTL1 (0.44) L3MBTL1KDM4EATMMAT2AMEN1
SCHEMBL25830316 0.80 KDM4E (0.49) L3MBTL1KDM4EATMJAK2JAK3
SCHEMBL25836579 0.79 KDM4E (0.45) L3MBTL1KDM4EATMMAT2AMEN1

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