SCHEMBL25854396

SCHEMBL25854396

c1ccc(C2(c3cccc(-c4ccc5c6c(cccc46)-c4ccccc4O5)c3)c3ccccc3-c3cc4ccccc4cc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
MAPK1 P28482 1/20 0.39
ATM Q13315 1/20 0.39
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
CHRNA1 P02708 1/20 0.31
CHRNG P07510 1/20 0.31
CHRNB1 P11230 1/20 0.31
CHRNB2 P17787 1/20 0.31
SLC6A2 P23975 1/20 0.31
CHRNB4 P30926 1/20 0.31
SLC6A4 P31645 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA4 P43681 1/20 0.31
SLC6A3 Q01959 1/20 0.31
CHRND Q07001 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
SCHEMBL25854123 0.93 KDM4E (0.40) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25859515 0.93 MAPK1 (0.42) KDM4EMAPK1ATMMAOAMAOB
SCHEMBL25854885 0.93 KDM4E (0.39) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25855010 0.91 MAPK1 (0.43) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25879170 0.89 KDM4E (0.39) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25859431 0.88 MAPK1 (0.43) KDM4EMAPK1ATMMAOAMAOB
SCHEMBL25842239 0.88 MAPK1 (0.43) KDM4EMAPK1ATMMAOAMAOB
SCHEMBL25879250 0.88 KDM4E (0.39) KDM4EMAPK1ATMCHRNA1CHRNG
SCHEMBL25842879 0.88 KDM4E (0.39) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25856217 0.88 KDM4E (0.39) KDM4EMAPK1ATMCHRNA1CHRNG

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