SCHEMBL25830675

SCHEMBL25830675

O=c1c2ccc3c4ccccc4n(-c4ccccc4)c3c2c2c(ccc3c4ccccc4n(-c4ccccc4)c32)n1-c1ccc2c3ccccc3c3ccccc3c2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.44
KMT2A Q03164 3/20 0.43
ALDH1A1 P00352 2/20 0.43
MEN1 O00255 2/20 0.43
POLB P06746 1/20 0.43
TSHR P16473 1/20 0.43
BRCA1 P38398 1/20 0.43
HSD17B10 Q99714 1/20 0.43
KDM4E B2RXH2 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
ATM Q13315 1/20 0.42
PGR P06401 4/20 0.40
CYP1A2 P05177 1/20 0.40
GLA P06280 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 1/20 0.40
CYP2C19 P33261 1/20 0.40
NPSR1 Q6W5P4 1/20 0.38
MAPK8 P45983 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
SCHEMBL25830671 0.92 KDM4E (0.50) MAPK1KMT2AALDH1A1MEN1POLB
SCHEMBL25830673 0.88 KMT2A (0.47) MAPK1KMT2AALDH1A1MEN1POLB
SCHEMBL25830607 0.85 KDM4E (0.50) MAPK1KMT2AALDH1A1MEN1POLB
SCHEMBL25830608 0.85 KDM4E (0.50) MAPK1KMT2AALDH1A1MEN1POLB
SCHEMBL18086298 0.85 L3MBTL1 (0.53) MAPK1KMT2AALDH1A1MEN1POLB
SCHEMBL16076348 0.85 L3MBTL1 (0.53) MAPK1KMT2AALDH1A1MEN1POLB
SCHEMBL16076377 0.85 L3MBTL1 (0.53) MAPK1KMT2AALDH1A1MEN1POLB
SCHEMBL25828636 0.85 KDM4E (0.44) MAPK1KMT2AALDH1A1MEN1POLB
SCHEMBL25828271 0.84 L3MBTL1 (0.45) MAPK1KMT2AALDH1A1MEN1POLB
SCHEMBL25828269 0.84 L3MBTL1 (0.45) MAPK1KMT2AALDH1A1MEN1POLB

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