SCHEMBL29211150

SCHEMBL29211150

CCCCc1ccc(C(=O)O)c(CCCC)c1C(=O)O.[NaH]

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BID P55957 6/20 0.48
MCL1 Q07820 6/20 0.48
BCL2L1 Q07817 5/20 0.48
BAK1 Q16611 5/20 0.48
PPARA Q07869 4/20 0.48
KAT8 Q9H7Z6 2/20 0.48
PPARG P37231 2/20 0.48
SAE1 Q9UBE0 2/20 0.48
EP300 Q09472 1/20 0.48
KAT2A Q92830 1/20 0.48
KAT2B Q92831 1/20 0.48
KAT5 Q92993 1/20 0.48
GABRP O00591 2/20 0.44
GABRD O14764 2/20 0.44
GABRA1 P14867 2/20 0.44
GABRB1 P18505 2/20 0.44
GABRG2 P18507 2/20 0.44
GABRB3 P28472 2/20 0.44
GABRA5 P31644 2/20 0.44
GABRA3 P34903 2/20 0.44

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
SCHEMBL31269 0.98 BID (0.49) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL6445743 0.94 BID (0.55) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL6446864 0.92 BID (0.57) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL6446413 0.92 BID (0.57) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL14836277 0.92 BID (0.57) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL2370160 0.92 BID (0.57) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL14836645 0.92 BID (0.57) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL6444123 0.92 BID (0.57) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL11594644 0.92 BID (0.57) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL2370706 0.92 BID (0.57) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114733468-B Functional polyester production system, production method and functional polyester fiber 中国纺织科学研究院有限公司 2024-07-12 CN disclosed
CN-114736362-B Functional polyester production system, preparation method and functional polyester fiber 中国纺织科学研究院有限公司 2024-04-16 CN disclosed
CN-114736357-B Functional polyester production system, production method and functional polyester fiber 中国纺织科学研究院有限公司 2024-04-09 CN disclosed