SCHEMBL6004174

SCHEMBL6004174

C/C=C/C#CC#C/C=C/CO

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SOAT2 O75908 1/20 0.33
SOAT1 P35610 1/20 0.33
HMGCR P04035 2/20 0.31

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
SCHEMBL30766182 0.75 TSHR (0.32) SOAT2SOAT1
SCHEMBL3192130 0.73 SOAT2 (0.30) SOAT2SOAT1
SCHEMBL3192126 0.73 SOAT2 (0.30) SOAT2SOAT1
SCHEMBL28071097 0.72 HMGCR (0.40) SOAT2SOAT1HMGCR
SCHEMBL28102522 0.72 HMGCR (0.40) SOAT2SOAT1HMGCR
SCHEMBL28804818 0.71 THRB (0.31) HMGCR
SCHEMBL7037053 0.70
SCHEMBL7037056 0.70
SCHEMBL30766358 0.70 FAAH (0.42) SOAT2SOAT1HMGCR
SCHEMBL29627131 0.69 FASN (0.45) HMGCR

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
US-20060086668-A1 Method for reducing fluoride ion content in calcium chloride SUNOCO, INC. (R&M) 2006-04-27 US disclosed