Heptanoate

Heptanoate

SCHEMBL5706644

CCCCCCC(=O)O.OCC(CO)(CO)COCC(CO)(CO)CO

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.61
PPARG P37231 7/20 0.61
PPARD Q03181 7/20 0.61
PPARA Q07869 7/20 0.61
HDAC11 Q96DB2 5/20 0.61
TSHR P16473 4/20 0.61
PTPN1 P18031 3/20 0.61
FABP4 P15090 3/20 0.61
ALDH1A1 P00352 2/20 0.61
TLR2 O60603 2/20 0.61
TDP1 Q9NUW8 2/20 0.61
KMT2A Q03164 2/20 0.61
FFAR1 O14842 2/20 0.61
FFAR4 Q5NUL3 2/20 0.61
ALOX15 P16050 2/20 0.61
HSD17B10 Q99714 2/20 0.61
SLC22A6 Q4U2R8 1/20 0.61
SLC22A8 Q8TCC7 1/20 0.61
MEN1 O00255 1/20 0.61
ESR1 P03372 1/20 0.61

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
Octanoic Acid SCHEMBL10570540 1.00 GPR84 (0.61) GPR84PPARGPPARDPPARAHDAC11
Behenic Acid SCHEMBL3374347 1.00 GPR84 (0.61) GPR84PPARGPPARDPPARAHDAC11
Nonadecanoic Acid SCHEMBL15879626 1.00 GPR84 (0.61) GPR84PPARGPPARDPPARAHDAC11
Heptanoate SCHEMBL5706635 1.00 GPR84 (0.61) GPR84PPARGPPARDPPARAHDAC11
Pentadecanoic Acid SCHEMBL15879882 1.00 GPR84 (0.61) GPR84PPARGPPARDPPARAHDAC11
Myristic Acid SCHEMBL18141444 1.00 GPR84 (0.61) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL3957766 1.00 GPR84 (0.61) GPR84PPARGPPARDPPARAHDAC11
Decanoic Acid SCHEMBL18140490 1.00 GPR84 (0.61) GPR84PPARGPPARDPPARAHDAC11
Behenic Acid SCHEMBL10479309 1.00 GPR84 (0.61) GPR84PPARGPPARDPPARAHDAC11
Palmitic Acid SCHEMBL7180370 1.00 GPR84 (0.61) GPR84PPARGPPARDPPARAHDAC11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118638578-A Lubricating oil for racing car and preparation method thereof 金丰宏润科技(广东)有限公司 2024-09-13 CN claimed
CN-118638578-A Lubricating oil for racing car and preparation method thereof 金丰宏润科技(广东)有限公司 2024-09-13 CN disclosed
CN-117264686-A Chain oil and preparation method and application thereof 中国石油化工股份有限公司 2023-12-22 CN disclosed
EP-1200666-B1 SPIN FINISH PERFORMANCE FIBERS INC (US) 2006-09-20 EP disclosed
US-7021349-B2 for tire cord yarn; ethoxylated alcohol or acid; ethoxylated glyceride, such as ethoxylated castor oil; ethoxylated silicone; a tetra- or hexacarboxylic ester PERFORMANCE FIBERS, INC. (US) 2006-04-04 US disclosed
US-20050142360-A1 Spin finish DURAFIBER TECHNOLOGIES (DFT), INC. (FORMERLY KNOWN AS PERFORMANCE FIBERS, INC.) 2005-06-30 US disclosed
US-6908579-B2 Extruding polymer to make yarn, applying spin finish composition including etherified polyoxyalkylene glycol, complex polyoxyethylene glyceride-containing compound, ethoxylated silicone, and polyester compound PERFORMANCE FIBERS, INC. (US) 2005-06-21 US disclosed
CN-1195919-C Spin finish ALLIED SIGNAL INC (US) 2005-04-06 CN disclosed
US-20040144951-A1 Spin finish ALLIEDSIGNAL INC. 2004-07-29 US disclosed
US-6712988-B2 MIXTURE OF POLYOXYALKYLENE ESTERS AND/OR ETHERS; ETHOXYLATED SILICONE; POLYESTER OR ETHER SUCH AS DIPENTAERYTHRITOL HEXAPELARGONATE AND PENTAERYTHRITOL TETRAPELARGONATE; IMPROVED STRENGTH AND WICKING. HONEYWELL INTERNATIONAL INC. 2004-03-30 US disclosed
US-20030035952-A1 Spin finish ALLIEDSIGNAL INC. 2003-02-20 US disclosed
CN-1377432-A Spinning oil ALLIED SIGNAL INC (US) 2002-10-30 CN disclosed
US-6426142-B1 Spin finish ALLIEDSIGNAL INC. 2002-07-30 US disclosed
EP-1200666-A1 SPIN FINISH AlliedSignal Inc. (US) 2002-05-02 EP disclosed
WO-2001009427-A1 SPIN FINISH ALLIEDSIGNAL INC. (US) 2001-02-08 WO disclosed
US-5073316-A Polyolefin resin, filler and an ester of dipentaerythritol; tear strength, permeability; sanitary absorbers MITSUBISHI KASEI VINYL COMPANY (JP) 1991-12-17 US disclosed
US-4322314-A SOLVENT EXRACTION OF A COBALT CARBONYL COMPLEX MITSUBISHI CHEMICAL IND. (JP) 1982-03-30 US disclosed