SCHEMBL25837996

SCHEMBL25837996

O=c1c2cc3c4cc(-n5c6ccccc6c6ccccc65)ccc4n(-c4ccccc4)c3cc2c2ccc3c4cc(-n5c6ccccc6c6ccccc65)ccc4n(-c4ccccc4)c3c2n1-c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
ATM Q13315 1/20 0.46
MAPK1 P28482 1/20 0.41
KMT2A Q03164 2/20 0.40
PGR P06401 4/20 0.40
MAPK8 P45983 3/20 0.39
MAPK9 P45984 2/20 0.39
ALDH1A1 P00352 3/20 0.38
HSD17B10 Q99714 2/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
TSHR P16473 1/20 0.38
BRCA1 P38398 1/20 0.38
CYP1A2 P05177 1/20 0.37
GLA P06280 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
HPGD P15428 1/20 0.37
CYP2C19 P33261 1/20 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
SCHEMBL25828903 0.97 L3MBTL1 (0.46) KDM4EL3MBTL1ATMMAPK1KMT2A
SCHEMBL25829015 0.95 KDM4E (0.51) KDM4EL3MBTL1ATMMAPK1KMT2A
SCHEMBL25828895 0.95 KDM4E (0.51) KDM4EL3MBTL1ATMMAPK1KMT2A
SCHEMBL23259860 0.91 L3MBTL1 (0.53) KDM4EL3MBTL1ATMMAPK1KMT2A
SCHEMBL22198480 0.91 KDM4E (0.53) KDM4EL3MBTL1ATMMAPK1KMT2A
SCHEMBL16940913 0.91 L3MBTL1 (0.53) KDM4EL3MBTL1ATMMAPK1KMT2A
SCHEMBL16940878 0.91 L3MBTL1 (0.53) KDM4EL3MBTL1ATMMAPK1KMT2A
SCHEMBL16940908 0.91 L3MBTL1 (0.53) KDM4EL3MBTL1ATMMAPK1KMT2A
SCHEMBL25829803 0.89 KDM4E (0.51) KDM4EL3MBTL1ATMMAPK1KMT2A
SCHEMBL25829737 0.89 KDM4E (0.51) KDM4EL3MBTL1ATMMAPK1KMT2A

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