SCHEMBL9000158

SCHEMBL9000158

CCOP(=O)(CCCCC=O)OCC

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 1/20 0.48
TSHR P16473 4/20 0.44
AOX1 Q06278 1/20 0.42
FAAH O00519 2/20 0.39
TRPV1 Q8NER1 1/20 0.39
HIF1A Q16665 1/20 0.36

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
SCHEMBL17764807 0.98 PPARD (0.47) PPARDTSHRAOX1FAAHTRPV1
SCHEMBL2382263 0.94 PPARD (0.50) PPARDTSHRAOX1FAAHTRPV1
SCHEMBL2382808 0.85 PPARD (0.54) PPARDTSHRAOX1
SCHEMBL7268189 0.84 PPARD (0.64) PPARDTSHR
SCHEMBL7268183 0.82 PPARD (0.61) PPARDTSHR
SCHEMBL11514496 0.82 PPARD (0.61) PPARDTSHR
SCHEMBL11323349 0.82 PPARD (0.61) PPARDTSHR
SCHEMBL1219734 0.82 PPARD (0.47) PPARDTSHR
SCHEMBL9701750 0.80 LPAR3 (0.47) PPARDTSHR
SCHEMBL2955740 0.80 LPAR3 (0.47) PPARDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0730408-A1 TRIAZOLE PHOSPHONATE PESTICIDES AgrEvo UK Limited (GB) 1996-09-11 EP disclosed
WO-1995014385-A1 TRIAZOLE PHOSPHONATE PESTICIDES AGREVO UK LIMITED (GB) 1995-06-01 WO disclosed