SCHEMBL25857623

SCHEMBL25857623

c1ccc(C2(c3cccc(-c4cccc5c4C4(c6ccccc6O5)c5ccccc5-c5ccccc54)c3)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
OPRK1 P41145 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
POLB P06746 1/20 0.32
BACE1 P56817 2/20 0.31
KCNH2 Q12809 2/20 0.31
CFTR P13569 1/20 0.30
GOPC Q9HD26 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
SCHEMBL25866767 0.97 MEN1 (0.38) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL25857286 0.92 KDM4E (0.35) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL25849243 0.90 MEN1 (0.37) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL25850080 0.90 MEN1 (0.41) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL25857279 0.89 KDM4E (0.35) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL25857531 0.88 ESR1 (0.37) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL25849240 0.88 MEN1 (0.37) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL25864355 0.87 ESR1 (0.36) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL25857539 0.86 MEN1 (0.38) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL25866769 0.86 MEN1 (0.44) MEN1KMT2AKDM4ELMNAMAPT

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