SCHEMBL25858623

SCHEMBL25858623

CC1(C)c2ccccc2Oc2cccc(-c3ccccc3C3(c4ccccc4)c4ccccc4-c4ccc5ccccc5c43)c21

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
KDM4E B2RXH2 4/20 0.32
MAPT P10636 3/20 0.32
LMNA P02545 2/20 0.32
THRB P10828 1/20 0.32
APEX1 P27695 1/20 0.32
HTT P42858 1/20 0.32
RECQL P46063 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MAPK1 P28482 2/20 0.31
ATM Q13315 1/20 0.31
OPRK1 P41145 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KIF11 P52732 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
SCHEMBL25858410 0.93 KDM4E (0.30) MEN1KMT2AKDM4EMAPTLMNA
SCHEMBL25850799 0.93 MEN1 (0.34) MEN1KMT2AKDM4EMAPTLMNA
SCHEMBL25858857 0.92 CHRNA1 (0.35)
SCHEMBL25867760 0.90 CHRNA1 (0.32)
SCHEMBL25856403 0.89 KDM4E (0.31) KDM4EMAPK1ATM
SCHEMBL25867014 0.88 DRD1 (0.33) MEN1KMT2AKDM4EMAPTLMNA
SCHEMBL25850325 0.88 KDM4E (0.33) MEN1KMT2AKDM4EMAPTLMNA
SCHEMBL25850630 0.86 PDK2 (0.31) MEN1KMT2A
SCHEMBL25853727 0.86 CHRNA1 (0.32) KDM4EMAPK1ATM
SCHEMBL25848908 0.86 KDM4E (0.37) MEN1KMT2AKDM4EMAPTLMNA

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