SCHEMBL25848524

SCHEMBL25848524

c1ccc2c(c1)Oc1cc(-c3ccc4c(c3)-c3ccccc3C43c4ccccc4-c4cc5ccccc5cc43)ccc1C21c2ccccc2-c2ccccc21

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 13/20 0.33
MEN1 O00255 3/20 0.33
MAPT P10636 3/20 0.33
KMT2A Q03164 3/20 0.33
FTO Q9C0B1 2/20 0.33
HTT P42858 2/20 0.33
HPGD P15428 1/20 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 2/20 0.32
LMNA P02545 2/20 0.32
MAPK1 P28482 1/20 0.32
ATM Q13315 1/20 0.32
OPRK1 P41145 1/20 0.32
SMN1; SMN2 Q16637 1/20 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
SCHEMBL25864079 0.96 PDK2 (0.37) PDK2
SCHEMBL25848170 0.96 PDK2 (0.37) PDK2
SCHEMBL25848519 0.94 KDM4E (0.37) PDK2MEN1MAPTKMT2AKDM4E
SCHEMBL25848516 0.92 CYP3A4 (0.32) PDK2MEN1MAPTKMT2AFTO
SCHEMBL25848724 0.91 MEN1 (0.37) PDK2MEN1MAPTKMT2AFTO
SCHEMBL25851560 0.90 PDK2 (0.35) PDK2MEN1MAPTKMT2AFTO
SCHEMBL25848165 0.90 KDM4E (0.36) PDK2MEN1MAPTKMT2AKDM4E
SCHEMBL25864159 0.90 KDM4E (0.36) PDK2MEN1MAPTKMT2AKDM4E
SCHEMBL22651772 0.90 KDM4E (0.38) PDK2MEN1MAPTKMT2AFTO
SCHEMBL25866176 0.89 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