Valeric Acid

Valeric Acid

SCHEMBL1869428

CCC/C=C/COC(=O)CCCC.CCCCC(=O)O

nearest known ligand 0.51

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.51
PPARD Q03181 5/20 0.51
PPARA Q07869 5/20 0.51
TERT O14746 3/20 0.51
PTPN1 P18031 3/20 0.51
MAPT P10636 3/20 0.51
BLM P54132 3/20 0.51
HSD17B10 Q99714 3/20 0.51
FABP4 P15090 3/20 0.51
F7 P08709 3/20 0.51
F3 P13726 3/20 0.51
TOP1 P11387 3/20 0.51
USP2 O75604 2/20 0.51
LMNA P02545 2/20 0.51
ALOX15 P16050 2/20 0.51
RECQL P46063 2/20 0.51
CYP19A1 P11511 2/20 0.51
PTGS1 P23219 2/20 0.51
NR4A2 P43354 2/20 0.51
KMT2A Q03164 2/20 0.51

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
SCHEMBL1532671 0.93 TSHR (0.53) MAPTHSD17B10ALOX15TDP1FAAH
SCHEMBL1771111 0.93 TSHR (0.53) MAPTHSD17B10ALOX15TDP1FAAH
SCHEMBL2035970 0.93 TSHR (0.53) MAPTHSD17B10ALOX15TDP1FAAH
SCHEMBL830242 0.88 TSHR (0.61) MAPTFAAHALDH1A1
SCHEMBL830241 0.88 TSHR (0.61) MAPTFAAHALDH1A1
SCHEMBL22590030 0.87 PPARG (0.67) PPARGPPARDPPARATERTPTPN1
SCHEMBL22589937 0.87 PPARG (0.72) PPARGPPARDPPARATERTPTPN1
SCHEMBL22033576 0.87 PPARG (0.72) PPARGPPARDPPARATERTPTPN1
SCHEMBL22602556 0.87 PPARG (0.72) PPARGPPARDPPARATERTPTPN1
SCHEMBL22590035 0.87 PPARG (0.72) PPARGPPARDPPARATERTPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011056934-A1 HIGH EFFICIENCY CAPSULES COMPRISING BENEFIT AGENT THE PROCTER & GAMBLE COMPANY (US) 2011-05-12 WO disclosed