SCHEMBL6654471

SCHEMBL6654471

COC(=O)CCCC[C@H](O)CC(=O)OC

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.58
TSHR P16473 3/20 0.54
PABPC1 P11940 1/20 0.50
APOBEC3A P31941 1/20 0.50
APOBEC3G Q9HC16 1/20 0.50
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
GPR84 Q9NQS5 4/20 0.41
PPARG P37231 2/20 0.40
FFAR4 Q5NUL3 1/20 0.40
FFAR1 O14842 1/20 0.40
RECQL P46063 1/20 0.39
PPARA Q07869 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
SCHEMBL7925338 1.00 L3MBTL1 (0.58) L3MBTL1TSHRPABPC1APOBEC3AAPOBEC3G
SCHEMBL10386766 0.98 L3MBTL1 (0.61) L3MBTL1TSHRPABPC1APOBEC3AAPOBEC3G
SCHEMBL4866020 0.89 GPR84 (0.56) L3MBTL1TSHRPABPC1APOBEC3AAPOBEC3G
SCHEMBL666477 0.89 FFAR4 (0.55) L3MBTL1TSHRPABPC1APOBEC3AAPOBEC3G
SCHEMBL4748826 0.89 FFAR4 (0.55) L3MBTL1TSHRPABPC1APOBEC3AAPOBEC3G
SCHEMBL7980859 0.89 GPR84 (0.56) L3MBTL1TSHRPABPC1APOBEC3AAPOBEC3G
SCHEMBL7918946 0.88 L3MBTL1 (0.51) L3MBTL1TSHRPABPC1APOBEC3AAPOBEC3G
SCHEMBL6653914 0.88 L3MBTL1 (0.55) L3MBTL1TSHRPABPC1APOBEC3AAPOBEC3G
SCHEMBL7927060 0.88 L3MBTL1 (0.55) L3MBTL1TSHRPABPC1APOBEC3AAPOBEC3G
SCHEMBL6652453 0.88 L3MBTL1 (0.51) L3MBTL1TSHRPABPC1APOBEC3AAPOBEC3G

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1318138-B1 Process for the preparation of dihydroxycarboxylic acid esters in the absence of solvents BASF AG (DE) 2004-09-29 EP disclosed
EP-1458667-A1 METHOD FOR THE PRODUCTION OF DIHYDROXYCARBOXYLATE ESTERS BASF AKTIENGESELLSCHAFT (DE) 2004-09-22 EP disclosed
WO-2003048102-A1 METHOD FOR THE PRODUCTION OF DIHYDROXYCARBOXYLATE ESTERS BASF AKTIENGESELLSCHAFT (DE) 2003-06-12 WO disclosed
EP-1318138-A1 Process for the preparation of dihydroxycarboxylic acid esters in the absence of solvents BASF AKTIENGESELLSCHAFT (DE) 2003-06-11 EP disclosed
EP-0992481-B1 Process for the asymmetric hydrogenation of beta-ketoesters BASF AG (DE) 2003-05-21 EP disclosed
US-6359165-B1 CATALYTIC HYDROGENATION OF CORRESPONDING KETOESTER USING RUTHENIUM COMPLEX BASF AKTIENEGESELLSCHAFT (DE) 2002-03-19 US disclosed
EP-0863125-B1 Process for the preparation of enantiomerically pure diesters of 3-hydroxyoctandioic acid by asymmetric catalytic hydrogenation ASTA MEDICA AG (DE) 2001-11-28 EP disclosed
EP-0992481-A1 Process for the asymmetric hydrogenation of beta-ketoesters BASF AKTIENGESELLSCHAFT (DE) 2000-04-12 EP disclosed
EP-0863125-A1 Process for the preparation of enantiomerically pure diesters of 3-hydroxyoctandioic acid by asymmetric catalytic hydrogenation ASTA Medica Aktiengesellschaft (DE) 1998-09-09 EP disclosed