SCHEMBL25848896

SCHEMBL25848896

CC1(C)c2ccccc2Oc2cc(-c3cccc4c3-c3ccccc3C4(C)C)ccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 3/20 0.33
FTO Q9C0B1 2/20 0.33
MEN1 O00255 2/20 0.33
MAPT P10636 2/20 0.33
HTT P42858 2/20 0.33
KMT2A Q03164 2/20 0.33
HPGD P15428 2/20 0.33
DRD1 P21728 2/20 0.33
CYP2C19 P33261 1/20 0.33
RECQL P46063 1/20 0.33
BLM P54132 1/20 0.33
SMAD3 P84022 1/20 0.33
PRMT1 Q99873 1/20 0.33
ACE2 Q9BYF1 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPK1 P28482 1/20 0.33
ATM Q13315 1/20 0.33
CYP3A4 P08684 1/20 0.32
ALDH1A1 P00352 2/20 0.32

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
SCHEMBL25848903 0.92 PDK2 (0.31) PDK2FTOMEN1MAPTHTT
SCHEMBL25848894 0.91 CTSD (0.33) PDK2DRD1KDM4EMAPK1ATM
SCHEMBL25847501 0.91 PDK2 (0.32) PDK2FTOMEN1MAPTHTT
SCHEMBL25851813 0.90 DRD1 (0.32) PDK2DRD1
SCHEMBL25848899 0.90 DRD1 (0.32) PDK2DRD1
SCHEMBL23028856 0.90 DRD1 (0.32) PDK2DRD1
SCHEMBL25871334 0.88 PDK2 (0.33) PDK2DRD1KDM4EMAPK1ATM
SCHEMBL25849774 0.87 DRD1 (0.32) PDK2MEN1MAPTKMT2ADRD1
SCHEMBL25872197 0.86 CTSD (0.32) DRD1KDM4EMAPK1ATM
SCHEMBL25872731 0.86 BACE1 (0.32) PDK2KDM4EMAPK1ATM

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