SCHEMBL3820001

SCHEMBL3820001

CCCCCC(=O)C(CC)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.54
AKR1B1 P15121 1/20 0.52
PPARG P37231 5/20 0.50
PPARD Q03181 5/20 0.50
PPARA Q07869 5/20 0.50
HDAC11 Q96DB2 4/20 0.50
TSHR P16473 3/20 0.50
GPR84 Q9NQS5 3/20 0.50
ALDH1A1 P00352 2/20 0.50
TLR2 O60603 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
FABP4 P15090 2/20 0.50
PTPN1 P18031 2/20 0.50
SLC22A6 Q4U2R8 1/20 0.50
SLC22A8 Q8TCC7 1/20 0.50
MEN1 O00255 1/20 0.50
ESR1 P03372 1/20 0.50
ALOX15 P16050 1/20 0.50
PDE4A P27815 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL5177333 0.98 CES2 (0.57) CES2PPARGPPARDPPARAHDAC11
SCHEMBL10885922 0.98 CES2 (0.57) CES2PPARGPPARDPPARAHDAC11
SCHEMBL11633109 0.98 CES2 (0.57) CES2PPARGPPARDPPARAHDAC11
SCHEMBL5177993 0.98 CES2 (0.57) CES2PPARGPPARDPPARAHDAC11
SCHEMBL11356070 0.98 CES2 (0.57) CES2PPARGPPARDPPARAHDAC11
SCHEMBL5176472 0.93 CA2 (0.46) CES2AKR1B1TSHRGPR84ALDH1A1
SCHEMBL2994868 0.88 CES2 (0.61) CES2PPARGPPARDPPARAHDAC11
SCHEMBL9246182 0.88 CES2 (0.61) CES2PPARGPPARDPPARAHDAC11
SCHEMBL3816304 0.84 CES2 (0.52) CES2AKR1B1PPARGPPARDPPARA
SCHEMBL11094684 0.84 CES2 (0.52) CES2AKR1B1PPARGPPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1361801-B1 AUTOINDUCER COMPOUNDS AND THEIR USES PATHWAY INTERMEDIATES LTD (GB) 2007-06-06 EP claimed
EP-0912467-B1 ASYMMETRIC HYDROGENATION METHOD OF A KETONIC COMPOUND AND DERIVATIVE RHODIA CHIMIE SA (FR) 2002-04-24 EP claimed
EP-1507010-B1 Control of the gene expression in eukaryotic cells CALGENE LLC (US) 2009-08-12 EP disclosed
US-7202085-B2 Control of gene expression in eukaryotic cells CALGENE LLC (US) 2007-04-10 US disclosed
EP-1190079-B1 CONTROL OF GENE EXPRESSION IN EUKARYOTIC CELLS CALGENE LLC (US) 2006-08-23 EP disclosed
US-20050227285-A1 Control of gene expression in eukaryotic cells MONSANTO COMPANY 2005-10-13 US disclosed
US-6943243-B2 Control of gene expression in eukaryotic cells CALGENE LLC (US) 2005-09-13 US disclosed
EP-1507010-A2 Control of the gene expression in eukaryotic cells Calgene LLC (US) 2005-02-16 EP disclosed
US-20030224483-A1 Control of gene expression in eukaryotic cells MONSANTO COMPANY 2003-12-04 US disclosed
US-6518066-B1 Control of gene expression in eukaryotic cells CALGENE LLC 2003-02-11 US disclosed
EP-1190079-A2 CONTROL OF GENE EXPRESSION IN EUKARYOTIC CELLS Calgene LLC (US) 2002-03-27 EP disclosed
WO-2001002593-A2 CONTROL OF GENE EXPRESSION IN EUKARYOTIC CELLS CALGENE LLC (US) 2001-01-11 WO disclosed
US-4291036-A Pyrido[1,2-A]pyrimidine derivatives and method of analgesic treatment CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA RT. (HU) 1981-09-22 US disclosed
US-4219649-A ANALGESICS CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA RT (HU) 1980-08-26 US disclosed