SCHEMBL25924136

SCHEMBL25924136

CC1(C)c2ccccc2-c2c1c(-c1ccc(-c3ccc(-c4nc(-c5ccccc5)c5ccccc5n4)cc3)cc1)nc1oc3ccccc3c21

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ATM Q13315 1/20 0.42
WHR1 P49842 1/20 0.35
PDE5A O76074 2/20 0.32
NUDT1 P36639 3/20 0.32
ADORA2A P29274 2/20 0.31
ABCG2 Q9UNQ0 2/20 0.31
TLR9 Q9NR96 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL25924132 0.93 KMT2A (0.33) MEN1KMT2AATMKDM4EALDH1A1
SCHEMBL25924131 0.93 KMT2A (0.33) MEN1KMT2AATMKDM4EALDH1A1
SCHEMBL25924128 0.92 KMT2A (0.34) MEN1KMT2AATMWHR1KDM4E
SCHEMBL25924134 0.89 MEN1 (0.34) MEN1KMT2AATMKDM4EALDH1A1
SCHEMBL25924624 0.86 KMT2A (0.41) MEN1KMT2AATMADORA2AKDM4E
SCHEMBL25925417 0.85 KMT2A (0.33) MEN1KMT2AATMKDM4EALDH1A1
SCHEMBL25924137 0.85 PIK3R1 (0.36) KMT2AATMTLR9KDM4EALDH1A1
SCHEMBL25924141 0.84 LMNA (0.31)
SCHEMBL25925414 0.84 KMT2A (0.34) MEN1KMT2AATMWHR1KDM4E
SCHEMBL25924133 0.83 KDM4E (0.31) KDM4EALDH1A1

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-2023138254-A1 HETEROCYCLIC COMPOUND, AND ORGANIC ELECTROLUMINESCENT MATERIAL AND ELEMENT 上海八亿时空先进材料有限公司 2023-07-27 WO disclosed