SCHEMBL25849431

SCHEMBL25849431

CC1(C)c2ccccc2Oc2cc(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)ccc21

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 16/20 0.38
FTO Q9C0B1 2/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
CYP2C19 P33261 1/20 0.35
HTT P42858 1/20 0.35
RECQL P46063 1/20 0.35
BLM P54132 1/20 0.35
SMAD3 P84022 1/20 0.35
KMT2A Q03164 1/20 0.35
PRMT1 Q99873 1/20 0.35
ACE2 Q9BYF1 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CYP3A4 P08684 1/20 0.33

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
SCHEMBL25849438 0.93 PDK2 (0.35) PDK2FTOMEN1MAPTHPGD
SCHEMBL25849627 0.92 FTO (0.35) PDK2FTOMEN1MAPTHPGD
SCHEMBL25849430 0.92 PDK2 (0.38) PDK2
SCHEMBL25847398 0.91 PDK2 (0.36) PDK2FTOMEN1MAPTHPGD
SCHEMBL25872804 0.91 PDK2 (0.40) PDK2
SCHEMBL16017949 0.89 PDK2 (0.38) PDK2
SCHEMBL25852484 0.89 PDK2 (0.35) PDK2FTOMEN1MAPTHPGD
SCHEMBL25849433 0.89 PDK2 (0.35) PDK2FTOMEN1MAPTHPGD
SCHEMBL25871488 0.88 PDK2 (0.40) PDK2
SCHEMBL25872288 0.88 PDK2 (0.38) PDK2

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