Nonanoate

Nonanoate

SCHEMBL3872823

CC(CO)CCO.CCCCCCCCC(=O)O.CCCCCCCCC(=O)O

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
FFAR1 O14842 2/20 0.61
FFAR4 Q5NUL3 2/20 0.61
KMT2A Q03164 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
Heptanoate SCHEMBL3871367 1.00 GPR84 (0.61) GPR84PPARGPPARDPPARAHDAC11
Octanoic Acid SCHEMBL3872215 1.00 GPR84 (0.61) GPR84PPARGPPARDPPARAHDAC11
Decanoic Acid SCHEMBL3875693 1.00 GPR84 (0.61) GPR84PPARGPPARDPPARAHDAC11
Octanoic Acid SCHEMBL721268 0.93 GPR84 (0.65) GPR84PPARGPPARDPPARAHDAC11
Decanoic Acid SCHEMBL3872764 0.93 GPR84 (0.65) GPR84PPARGPPARDPPARAHDAC11
Undecanoate SCHEMBL720592 0.93 GPR84 (0.65) GPR84PPARGPPARDPPARAHDAC11
Tridecanoate SCHEMBL721497 0.93 GPR84 (0.65) GPR84PPARGPPARDPPARAHDAC11
Heptanoate SCHEMBL160363 0.93 GPR84 (0.65) GPR84PPARGPPARDPPARAHDAC11
Nonanoate SCHEMBL723513 0.93 GPR84 (0.65) GPR84PPARGPPARDPPARAHDAC11
Octanoic Acid SCHEMBL3870927 0.91 GPR84 (0.59) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3351611-A1 REFRIGERATION MACHINE OIL, COMPOSITION FOR REFRIGERATION MACHINES, AND COMPRESSION-TYPE REFRIGERATION MACHINE Idemitsu Kosan Co., Ltd (JP) 2018-07-25 EP disclosed
US-7517838-B2 Lubricating oil for bearing NEW JAPAN CHEMICAL CO., LTD. (JP) 2009-04-14 US disclosed
US-20060019840-A1 Lubricating oil for bearing NEW JAPAN CHEMICAL CO., LTD. (JP) 2006-01-26 US disclosed