SCHEMBL25868722

SCHEMBL25868722

c1ccc2c(c1)-c1c(-c3ccc(-c4ccc5c(c4)-c4cccc6cccc(c46)O5)cc3)cccc1C21c2ccccc2-c2c1ccc1ccccc21

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
MAPK1 P28482 1/20 0.44
ATM Q13315 1/20 0.44
TYMS P04818 1/20 0.33
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 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
SCHEMBL25842055 0.96 KDM4E (0.46) KDM4EMAPK1ATMTYMS
SCHEMBL25878906 0.94 KDM4E (0.46) KDM4EMAPK1ATMTYMS
SCHEMBL25868270 0.92 MAPK1 (0.44) KDM4EMAPK1ATMTYMS
SCHEMBL25860061 0.92 KDM4E (0.44) KDM4EMAPK1ATMTYMS
SCHEMBL25841943 0.92 KDM4E (0.44) KDM4EMAPK1ATMTYMS
SCHEMBL25868721 0.91 MAPK1 (0.50) KDM4EMAPK1ATMTYMS
SCHEMBL25878744 0.91 MAPK1 (0.41) KDM4EMAPK1ATMTYMS
SCHEMBL25868635 0.90 KDM4E (0.42) KDM4EMAPK1ATMTYMSCA12
SCHEMBL25870081 0.90 KDM4E (0.42) KDM4EMAPK1ATMTYMS
SCHEMBL25868636 0.89 KDM4E (0.48) KDM4EMAPK1ATMTYMS

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