SCHEMBL25843234

SCHEMBL25843234

c1ccc(C2(c3ccccc3)c3ccccc3-c3c(-c4ccc5cccc6c5c4Oc4ccccc4-6)cccc32)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.44
MAPK1 P28482 2/20 0.44
ATM Q13315 2/20 0.44
TYMS P04818 1/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
OPRK1 P41145 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL25854002 0.91 MAPK1 (0.47) KDM4EMAPK1ATMTYMSMEN1
SCHEMBL25841800 0.91 MAPK1 (0.47) KDM4EMAPK1ATMTYMSALDH1A1
SCHEMBL25842716 0.89 KDM4E (0.45) KDM4EMAPK1ATMTYMSMEN1
SCHEMBL25843048 0.89 MAPK1 (0.45) KDM4EMAPK1ATMTYMSALDH1A1
SCHEMBL25843233 0.88 MAPK1 (0.47) KDM4EMAPK1ATMTYMSMEN1
SCHEMBL25853910 0.87 KDM4E (0.40) KDM4EMAPK1ATM
SCHEMBL25855643 0.86 KDM4E (0.43) KDM4EMAPK1ATMTYMSMEN1
SCHEMBL25841958 0.85 KDM4E (0.42) KDM4EMAPK1ATMTYMS
SCHEMBL25859575 0.85 KDM4E (0.42) KDM4EMAPK1ATMTYMSMEN1
SCHEMBL25843232 0.85 KDM4E (0.46) KDM4EMAPK1ATMTYMSMEN1

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-2023120714-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-06-29 WO disclosed