SCHEMBL25879170

SCHEMBL25879170

c1ccc(C2(c3ccc4ccccc4c3)c3ccccc3-c3ccc(-c4ccc5c6c(cccc46)-c4ccccc4O5)cc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
MAPK1 P28482 1/20 0.39
ATM Q13315 1/20 0.39
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
OPRK1 P41145 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30

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
SCHEMBL25842879 0.92 KDM4E (0.39) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25854123 0.90 KDM4E (0.40) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25859515 0.90 MAPK1 (0.42) KDM4EMAPK1ATM
SCHEMBL25903778 0.89 KDM4E (0.41) KDM4EMAPK1ATM
SCHEMBL25854396 0.89 KDM4E (0.39) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25879169 0.89 KDM4E (0.41) KDM4EMAPK1ATM
SCHEMBL25879006 0.88 KDM4E (0.43) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25875295 0.88 MAPK1 (0.33) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25854885 0.87 KDM4E (0.39) KDM4EMAPK1ATMMEN1LMNA
SCHEMBL25855638 0.87 KDM4E (0.41) KDM4EMAPK1ATMMEN1LMNA

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