SCHEMBL6447204

SCHEMBL6447204

CC(C)CCCCCCCc1ccc(C(=O)O)c(CCCCCCCC(C)C)c1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BID P55957 7/20 0.40
MCL1 Q07820 7/20 0.40
BCL2L1 Q07817 6/20 0.40
BAK1 Q16611 6/20 0.40
PPARA Q07869 3/20 0.40
KAT8 Q9H7Z6 2/20 0.40
PPARG P37231 2/20 0.40
SAE1 Q9UBE0 2/20 0.40
EP300 Q09472 1/20 0.40
KAT2A Q92830 1/20 0.40
KAT2B Q92831 1/20 0.40
KAT5 Q92993 1/20 0.40
GRIN2D O15399 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
RARB P10826 1/20 0.36
MMP2 P08253 2/20 0.36
F7 P08709 2/20 0.36
F3 P13726 2/20 0.36

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
SCHEMBL6444886 1.00 BID (0.40) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL3684727 1.00 BID (0.40) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL14836326 1.00 BID (0.40) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL14989256 1.00 BID (0.40) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL10815288 1.00 BID (0.40) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL6445043 0.94 GRIN2D (0.40) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL27508212 0.90 RARB (0.38) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL10818422 0.89 BID (0.38) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL721825 0.89 BID (0.38) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL23670 0.89 BID (0.38) 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3964543-B1 PLASTICIZER COMPOSITION AND RESIN COMPOSITION INCLUDING THE SAME LG CHEMICAL LTD (KR) 2023-03-15 EP claimed
EP-1567470-B1 HYDROGENATION OF BENZENE POLYCARBOXYLIC ACIDS OR DERIVATIVES THEREOF EXXONMOBIL CHEM PATENTS INC (US) 2013-06-05 EP claimed
EP-1194396-A1 SELECTED CYCLOHEXANE-1,3- AND 1,4-DICARBOXYLIC ACID ESTERS BASF AKTIENGESELLSCHAFT (DE) 2002-04-10 EP claimed
WO-2000078704-A1 SELECTED CYCLOHEXANE-1,3- AND 1,4-DICARBOXYLIC ACID ESTERS BASF AKTIENGESELLSCHAFT (DE) 2000-12-28 WO claimed
EP-2576674-B1 PROCESS FOR MAKING EXPANDABLE COMPOSITIONS BASED ON STYRENEPOLYMER BASF SE (DE) 2014-08-27 EP disclosed
EP-2576674-A1 METHOD FOR PRODUCING EXPANDABLE STYRENE POLYMER COMPOSITIONS BASF SE (DE) 2013-04-10 EP disclosed
EP-1194396-B1 SELECTED CYCLOHEXANE-1,3- AND 1,4-DICARBOXYLIC ACID ESTERS BASF AG (DE) 2005-11-09 EP disclosed
EP-1194396-A1 SELECTED CYCLOHEXANE-1,3- AND 1,4-DICARBOXYLIC ACID ESTERS BASF AKTIENGESELLSCHAFT (DE) 2002-04-10 EP disclosed
WO-2000078704-A1 SELECTED CYCLOHEXANE-1,3- AND 1,4-DICARBOXYLIC ACID ESTERS BASF AKTIENGESELLSCHAFT (DE) 2000-12-28 WO disclosed
US-4963311-A GRAFTING A PHOSPHITE-MODIFIED POLYESTER BASED ON A CARBO DIACID AND A CARBO OR ACYCLIC GLYCOL TO A NYLON; SPINNING AND DRAWING ALLIED-SIGNAL (US) 1990-10-16 US disclosed