SCHEMBL6135465

SCHEMBL6135465

CCC=CC=CCC(CCCC)OC(C)=O

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GLS2 Q9UI32 3/20 0.37
PRKCA P17252 2/20 0.37
TRPV1 Q8NER1 1/20 0.36
ACHE P22303 1/20 0.35
BACE1 P56817 1/20 0.35
CTSK P43235 2/20 0.35
FPR2 P25090 1/20 0.34
PTPN1 P18031 1/20 0.33
GALR3 O60755 1/20 0.33

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
SCHEMBL832571 1.00 GLS2 (0.37) GLS2PRKCATRPV1ACHEBACE1
SCHEMBL833202 1.00 GLS2 (0.37) GLS2PRKCATRPV1ACHEBACE1
SCHEMBL5697377 0.86 TRPV1 (0.42) GLS2PRKCATRPV1
SCHEMBL831893 0.86 FASN (0.39) GLS2PRKCACTSK
SCHEMBL6430756 0.86 FASN (0.39) GLS2PRKCACTSK
SCHEMBL5697322 0.86 FASN (0.39) GLS2PRKCACTSK
SCHEMBL8439260 0.84 TRPV1 (0.45) GLS2PRKCATRPV1
SCHEMBL31216703 0.84 TRPV1 (0.45) GLS2PRKCATRPV1
SCHEMBL17396607 0.84 TRPV1 (0.45) GLS2PRKCATRPV1
SCHEMBL31216719 0.84 TRPV1 (0.45) GLS2PRKCATRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1608223-A1 INSECT CONTROL SYSTEM Agrisense-BCS Limited (GB) 2005-12-28 EP claimed
WO-2004086866-A1 INSECT CONTROL SYSTEM AGRISENSE-BCS LIMITED (GB) 2004-10-14 WO claimed
WO-2022058689-A1 SURFACE-COATING FLUID COMPOSITION FOR ABSORBING AND DIFFUSING VOLATILE COMPOUNDS MELCHIOR MATERIAL AND LIFE SCIENCE FRANCE (FR) 2022-03-24 WO disclosed
EP-1608223-A1 INSECT CONTROL SYSTEM Agrisense-BCS Limited (GB) 2005-12-28 EP disclosed
WO-2004086866-A1 INSECT CONTROL SYSTEM AGRISENSE-BCS LIMITED (GB) 2004-10-14 WO disclosed