SCHEMBL2564556

SCHEMBL2564556

CCCCCCCCCCCCCCCCCCc1ccccc1C(=O)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.53
BID P55957 3/20 0.53
MCL1 Q07820 3/20 0.53
BCL2L1 Q07817 2/20 0.53
BAK1 Q16611 2/20 0.53
KAT8 Q9H7Z6 2/20 0.53
PPARA Q07869 2/20 0.53
PPARG P37231 1/20 0.53
EP300 Q09472 1/20 0.53
KAT2A Q92830 1/20 0.53
KAT2B Q92831 1/20 0.53
KAT5 Q92993 1/20 0.53
SAE1 Q9UBE0 1/20 0.53
CYSLTR2 Q9NS75 9/20 0.50
CYSLTR1 Q9Y271 9/20 0.50
THRA P10827 1/20 0.48
THRB P10828 1/20 0.48

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
SCHEMBL18759158 1.00 LIPG (0.53) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL11207460 0.93 FOLH1 (0.44) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL467028 0.86 BID (0.59) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL7920927 0.86 BID (0.59) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL194425 0.86 BID (0.59) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL8925891 0.86 BID (0.59) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL586009 0.86 BID (0.59) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL5710015 0.86 BID (0.59) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL1562330 0.86 BID (0.59) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL1691931 0.86 BID (0.59) LIPGBIDMCL1BCL2L1BAK1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2038341-B1 COMPOSITION WITH A POLYMER AND AN OXIDATION-CATALYST DSM IP ASSETS BV (NL) 2011-11-02 EP disclosed
US-20100130695-A1 COMPOSITION WITH A POLYMER AND AN OXIDATION-CATALYST DSM IP ASSETS B.V. (NL) 2010-05-27 US disclosed
EP-2038341-A1 COMPOSITION WITH A POLYMER AND AN OXIDATION-CATALYST DSMIP Assets B.V. (NL) 2009-03-25 EP disclosed
WO-2008006493-A1 COMPOSITION WITH A POLYMER AND AN OXIDATION-CATALYST DSM IP ASSETS B.V. (NL) 2008-01-17 WO disclosed