SCHEMBL25855640

SCHEMBL25855640

c1ccc(C2(c3ccc(-c4ccc5cccc6c5c4-c4ccccc4O6)cc3)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.43
MAPK1 P28482 1/20 0.43
ATM Q13315 1/20 0.43
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
OPRK1 P41145 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TYMS P04818 1/20 0.34
POLB P06746 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
SCHEMBL25854232 0.93 KDM4E (0.38) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25843520 0.92 KDM4E (0.40) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25855931 0.91 KDM4E (0.38) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25854887 0.91 KDM4E (0.41) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25862944 0.90 KDM4E (0.47) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25843232 0.89 KDM4E (0.46) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25855474 0.88 KDM4E (0.45) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25863172 0.86 MAPK1 (0.40) KDM4EMAPK1ATMTYMS
SCHEMBL25841653 0.85 KDM4E (0.45) KDM4EMAPK1ATMTYMS
SCHEMBL25856079 0.84 KDM4E (0.42) KDM4EMAPK1ATMMEN1KMT2A

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