SCHEMBL25848716

SCHEMBL25848716

CC1(C)c2ccccc2Oc2cccc(-c3ccc4c(c3)-c3ccccc3C43c4ccccc4-c4ccccc43)c21

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.32
MAPT P10636 2/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
OPRK1 P41145 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
RARB P10826 2/20 0.32
RXRA P19793 2/20 0.32
RARG P13631 1/20 0.32
CTSD P07339 2/20 0.31
BACE1 P56817 2/20 0.31
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
PDK2 Q15119 2/20 0.30
HPGD P15428 1/20 0.30
CYP2C19 P33261 1/20 0.30
HTT P42858 1/20 0.30
RECQL P46063 1/20 0.30
BLM P54132 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
SCHEMBL25848427 0.93 KDM4E (0.31) KDM4ECTSDBACE1
SCHEMBL25850072 0.92 KDM4E (0.38) MEN1MAPTKMT2AKDM4ELMNA
SCHEMBL25847396 0.92 PDK2 (0.35) RARBRXRARARGCTSDBACE1
SCHEMBL25849636 0.88 DRD1 (0.32) MEN1MAPTKMT2AKDM4ELMNA
SCHEMBL25847924 0.88 KDM4E (0.30) KDM4E
SCHEMBL25848159 0.87 PDK2 (0.34) KDM4ECTSDBACE1PDK2
SCHEMBL25867758 0.87 PDK2 (0.34) KDM4ECTSDBACE1PDK2
SCHEMBL25848990 0.87 RARB (0.32) RARBRXRARARGCTSDBACE1
SCHEMBL25848718 0.86 MEN1 (0.34) MEN1MAPTKMT2AKDM4ELMNA
SCHEMBL25848717 0.84 PDK2 (0.33) MEN1MAPTKMT2AKDM4ELMNA

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