SCHEMBL25859515

SCHEMBL25859515

c1ccc(C2(c3ccccc3)c3cc(-c4ccc5c6c(cccc46)-c4ccccc4O5)ccc3-c3cc4ccccc4cc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.42
KDM4E B2RXH2 1/20 0.42
ATM Q13315 1/20 0.42
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
ALDH1A1 P00352 2/20 0.31
HPGD P15428 2/20 0.31
TSHR P16473 2/20 0.31
CASP1 P29466 2/20 0.31
HIF1A Q16665 2/20 0.31
HSD17B10 Q99714 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
TP53 P04637 1/20 0.31
CASP7 P55210 1/20 0.31
MCL1 Q07820 1/20 0.30
ACMSD Q8TDX5 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
SCHEMBL25854123 0.94 KDM4E (0.40) MAPK1KDM4EATMMAOAMAOB
SCHEMBL25903778 0.93 KDM4E (0.41) MAPK1KDM4EATM
SCHEMBL25854396 0.93 KDM4E (0.39) MAPK1KDM4EATMMAOAMAOB
SCHEMBL25859431 0.91 MAPK1 (0.43) MAPK1KDM4EATMMAOAMAOB
SCHEMBL25842239 0.91 MAPK1 (0.43) MAPK1KDM4EATMMAOAMAOB
SCHEMBL25842879 0.91 KDM4E (0.39) MAPK1KDM4EATM
SCHEMBL25879170 0.90 KDM4E (0.39) MAPK1KDM4EATM
SCHEMBL25859516 0.89 KDM4E (0.40) MAPK1KDM4EATMMAOAMAOB
SCHEMBL25875295 0.89 MAPK1 (0.33) MAPK1KDM4EATMALDH1A1HPGD
SCHEMBL25855010 0.89 MAPK1 (0.43) MAPK1KDM4EATMMAOAMAOB

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