SCHEMBL25875385

SCHEMBL25875385

c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(-c4cc5c(c6ccccc46)Oc4c(ccc6ccccc46)C54c5ccccc5-c5ccccc54)cc32)cc1

nearest known ligand 0.32

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.32
KMT2A Q03164 3/20 0.32
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 2/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
OPRK1 P41145 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP1A1 P04798 1/20 0.32
CYP1A2 P05177 1/20 0.32
FYN P06241 1/20 0.32
MAPK3 P27361 1/20 0.32
AHR P35869 1/20 0.32
PAX8 Q06710 1/20 0.32
ABCG2 Q9UNQ0 1/20 0.32
MAPK1 P28482 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
SCHEMBL25875390 0.93 KMT2A (0.35) PDK2KMT2AKDM4EMEN1LMNA
SCHEMBL25876500 0.89 KIF11 (0.31) KMT2AKDM4EMEN1LMNAMAPT
SCHEMBL25874429 0.89 GPR84 (0.32)
SCHEMBL25875066 0.88
SCHEMBL25874824 0.87 PDK2 (0.35) PDK2KDM4EMAPTCYP1A2
SCHEMBL25865393 0.87 GPR84 (0.30)
SCHEMBL25875718 0.86 PDK2 (0.30) PDK2KDM4EMAPT
SCHEMBL20387550 0.85 PDK2 (0.33) PDK2
SCHEMBL20387374 0.85 PDK2 (0.30) PDK2
SCHEMBL25852117 0.85 PDK2 (0.34) PDK2KMT2AKDM4EMEN1LMNA

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