SCHEMBL25828636

SCHEMBL25828636

O=c1c2c(ccc3c4ccccc4n(-c4ccccc4)c32)c2ccc3c(c4ccccc4n3-c3ccc4c5ccccc5c5ccccc5c4c3)c2n1-c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
ATM Q13315 1/20 0.44
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
ALDH1A1 P00352 2/20 0.39
JAK2 O60674 1/20 0.39
JAK3 P52333 1/20 0.39
POLB P06746 1/20 0.39
TSHR P16473 1/20 0.39
BRCA1 P38398 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MAPK1 P28482 1/20 0.39
MAPK8 P45983 2/20 0.36
PGR P06401 3/20 0.35
MAPK9 P45984 1/20 0.35
HKDC1 Q2TB90 1/20 0.34
LMNA P02545 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CYP1A2 P05177 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
SCHEMBL25828269 0.92 L3MBTL1 (0.45) KDM4EL3MBTL1ATMKMT2AMEN1
SCHEMBL25828271 0.92 L3MBTL1 (0.45) KDM4EL3MBTL1ATMKMT2AMEN1
SCHEMBL25828517 0.92 KDM4E (0.51) KDM4EL3MBTL1ATMKMT2AMEN1
SCHEMBL16076377 0.91 L3MBTL1 (0.53) KDM4EL3MBTL1ATMKMT2AMEN1
SCHEMBL18086298 0.91 L3MBTL1 (0.53) KDM4EL3MBTL1ATMKMT2AMEN1
SCHEMBL16076348 0.91 L3MBTL1 (0.53) KDM4EL3MBTL1ATMKMT2AMEN1
SCHEMBL26809304 0.90 L3MBTL1 (0.51) KDM4EL3MBTL1ATMKMT2AMEN1
SCHEMBL26472280 0.90 L3MBTL1 (0.51) KDM4EL3MBTL1ATMKMT2AMEN1
SCHEMBL19797701 0.89 L3MBTL1 (0.50) KDM4EL3MBTL1ATMKMT2AMEN1
SCHEMBL27044609 0.89 L3MBTL1 (0.50) KDM4EL3MBTL1ATMKMT2AMEN1

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