SCHEMBL25855643

SCHEMBL25855643

c1ccc(C2(c3ccc(-c4ccc5cccc6c5c4Oc4ccccc4-6)cc3)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.43
MAPK1 P28482 2/20 0.43
ATM Q13315 2/20 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 0.31
POLB P06746 1/20 0.31
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30
HSD17B10 Q99714 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
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
SCHEMBL25854235 0.93 KDM4E (0.38) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25842882 0.93 KDM4E (0.41) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25843523 0.92 KDM4E (0.40) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25855934 0.91 KDM4E (0.38) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25854888 0.91 KDM4E (0.41) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25854699 0.90 KDM4E (0.37) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25854002 0.90 MAPK1 (0.47) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25855642 0.88 KDM4E (0.45) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25842716 0.88 KDM4E (0.45) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25843234 0.86 KDM4E (0.44) 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