SCHEMBL25850325

SCHEMBL25850325

CC1(C)c2ccccc2Oc2cccc(-c3cccc4c3-c3ccccc3C43c4ccccc4-c4ccc5ccccc5c43)c21

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
MAPK1 P28482 1/20 0.33
ATM Q13315 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
DNMT1 P26358 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
APEX1 P27695 1/20 0.31
HTT P42858 1/20 0.31
RECQL P46063 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL22706094 0.92
SCHEMBL25850799 0.90 MEN1 (0.34) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25850388 0.90 KDM4E (0.36) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25847686 0.89 KDM4E (0.33) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25850324 0.89 MEN1 (0.30) MEN1KMT2ADNMT1
SCHEMBL25858623 0.88 MEN1 (0.33) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25853478 0.87 KDM4E (0.30) KDM4EMAPK1ATM
SCHEMBL25850630 0.86 PDK2 (0.31) MEN1KMT2A
SCHEMBL25847499 0.86 KDM4E (0.33) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL25872194 0.86

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