SCHEMBL29620154

SCHEMBL29620154

CC(C)CCCCCCCc1c(CCCCCC(C)C)ccc(C(=O)O)c1C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BID P55957 4/20 0.38
MCL1 Q07820 4/20 0.38
BCL2L1 Q07817 3/20 0.38
BAK1 Q16611 3/20 0.38
PPARA Q07869 3/20 0.38
KAT8 Q9H7Z6 2/20 0.38
PPARG P37231 1/20 0.38
EP300 Q09472 1/20 0.38
KAT2A Q92830 1/20 0.38
KAT2B Q92831 1/20 0.38
KAT5 Q92993 1/20 0.38
SAE1 Q9UBE0 1/20 0.38
RARB P10826 2/20 0.36
GRIN2D O15399 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
SLC16A3 O15427 2/20 0.35
HIF1A Q16665 1/20 0.35
EPAS1 Q99814 1/20 0.35

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
SCHEMBL721825 1.00 BID (0.38) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL23670 1.00 BID (0.38) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL37016 1.00 BID (0.38) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL479330 1.00 BID (0.38) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL37130 1.00 BID (0.38) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL23222 1.00 BID (0.38) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL10818422 1.00 BID (0.38) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL541811 0.99 RARB (0.37) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL5180435 0.95 BID (0.43) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL5516325 0.95 BID (0.43) BIDMCL1BCL2L1BAK1PPARA

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-2022080458-A1 MULTILAYER STRUCTURE, AND PACKAGING MATERIAL USING SAME 株式会社クラレ 2022-04-21 WO disclosed