SCHEMBL5519682

SCHEMBL5519682

CCCCc1ccc(C(=O)O)c(C(=O)O)c1CCCCCC(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BID P55957 6/20 0.43
MCL1 Q07820 6/20 0.43
BCL2L1 Q07817 5/20 0.43
BAK1 Q16611 5/20 0.43
PPARA Q07869 5/20 0.43
PPARG P37231 3/20 0.43
KAT8 Q9H7Z6 2/20 0.43
SAE1 Q9UBE0 2/20 0.43
EP300 Q09472 1/20 0.43
KAT2A Q92830 1/20 0.43
KAT2B Q92831 1/20 0.43
KAT5 Q92993 1/20 0.43
ALDH1A1 P00352 1/20 0.40
RARB P10826 1/20 0.40
METAP2 P50579 1/20 0.38
MMP2 P08253 2/20 0.38
F7 P08709 2/20 0.38
F3 P13726 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL5514891 1.00 BID (0.43) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL8965931 1.00 BID (0.43) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL5525305 1.00 BID (0.43) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL5523698 1.00 BID (0.43) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL5180435 1.00 BID (0.43) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL5519803 1.00 BID (0.43) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL5519100 1.00 BID (0.43) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL5523259 1.00 BID (0.43) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL5516325 1.00 BID (0.43) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL5515032 1.00 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7282601-B2 Dicarboxylic diester, process for producing the same, and refrigerating machine lubricating oil comprising the ester NEW JAPAN CHEMICAL CO., LTD. (JP) 2007-10-16 US disclosed
US-7271282-B1 Dicarboxylic diester, process for producing the same, and refrigerating machine lubricating oil comprising the ester NEW JAPAN CHEMICAL CO., LTD. (JP) 2007-09-18 US disclosed
EP-1227078-A1 DICARBOXYLIC DIESTER, PROCESS FOR PRODUCING THE SAME, AND REFRIGERATING MACHINE LUBRICATING OIL COMPRISING THE ESTER NEW JAPAN CHEMICAL CO.,LTD. (JP) 2002-07-31 EP disclosed