Valeric Acid

Valeric Acid

SCHEMBL6158046

CCCCC(=O)O.Cc1ccccc1

nearest known ligand 0.54

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.54
CES2 O00748 2/20 0.53
CES1 P23141 2/20 0.53
GPR84 Q9NQS5 7/20 0.52
PPARG P37231 7/20 0.52
PPARD Q03181 7/20 0.52
PPARA Q07869 7/20 0.52
HDAC11 Q96DB2 6/20 0.52
TSHR P16473 4/20 0.52
PTPN1 P18031 3/20 0.52
ALDH1A1 P00352 2/20 0.52
TLR2 O60603 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
FABP4 P15090 2/20 0.52
SLC22A6 Q4U2R8 1/20 0.52
SLC22A8 Q8TCC7 1/20 0.52
MEN1 O00255 1/20 0.52
ESR1 P03372 1/20 0.52
ALOX15 P16050 1/20 0.52
PDE4A P27815 1/20 0.52

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
Valeric Acid SCHEMBL3708267 0.96 CES2 (0.50) AKR1B1CES2CES1GPR84PPARG
Valeric Acid SCHEMBL3708269 0.96 CES2 (0.50) AKR1B1CES2CES1GPR84PPARG
Hexanoate SCHEMBL9352753 0.94 AKR1B1 (0.64) AKR1B1CES2CES1GPR84PPARG
Decanoic Acid SCHEMBL18585995 0.92 GPR84 (0.65) AKR1B1CES2CES1GPR84PPARG
Hexanoate SCHEMBL28176592 0.92 AKR1B1 (0.61) AKR1B1CES2CES1GPR84PPARG
Stearic Acid SCHEMBL8908104 0.92 GPR84 (0.65) AKR1B1CES2CES1GPR84PPARG
Palmitic Acid SCHEMBL11331040 0.92 GPR84 (0.65) AKR1B1CES2CES1GPR84PPARG
Hexanoate SCHEMBL28850767 0.92 AKR1B1 (0.61) AKR1B1CES2CES1GPR84PPARG
Octanoic Acid SCHEMBL6273782 0.92 GPR84 (0.65) AKR1B1CES2CES1GPR84PPARG
P-Xylene SCHEMBL28841742 0.91 AKR1B1 (0.58) AKR1B1GPR84PPARGPPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0867646-B1 Material for a gasket coated with foam rubber and manufacturing process of the same NICHIAS CORP (JP) 2005-02-09 EP disclosed
EP-0952137-B1 Process for the preparation of 2,3,5-trimethylhydroquinone diester DEGUSSA (DE) 2004-07-21 EP disclosed
EP-0952137-A1 Process for the preparation of 2,3,5-trimethylhydroquinone diester Degussa-Hüls Aktiengesellschaft (DE) 1999-10-27 EP disclosed
US-5958571-A RESILIENCY AND RESISTANCE TO PRESSURE OF FOAM RUBBER LAYERS AFTER EXPOSURE TO HIGH TEMPERATURE NICHIAS CORPORATION (JP) 1999-09-28 US disclosed
EP-0867646-A2 Material for a gasket coated with foam rubber NICHIAS CORPORATION (JP) 1998-09-30 EP disclosed
US-5760257-A AN ADDITION-CONDENSATION COPOLYMER COMPRISING ALLYL GROUP, POLYESTER, POLYAMIDE AND/OR POLYETHER; RECEPTIVITY; ANTIAGGLOMERANTS AJINOMOTO CO., INC. (JP) 1998-06-02 US disclosed