SCHEMBL6245461

SCHEMBL6245461

CCCC=COOC=CCCC

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL31323907 0.85
SCHEMBL8009240 0.80 TSHR (0.35) TSHRALDH1A1
SCHEMBL76817 0.80 TSHR (0.35) TSHRALDH1A1
SCHEMBL3945045 0.80 TSHR (0.35) TSHRALDH1A1
SCHEMBL387656 0.78
SCHEMBL19721528 0.78
SCHEMBL9132693 0.78
SCHEMBL23673186 0.77 FAAH (0.52) TSHR
SCHEMBL28872234 0.77 FAAH (0.52) TSHR
SCHEMBL7517949 0.77 FAAH (0.52) TSHR

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-2005026298-A1 SELF LUBRICATING ALTERNATIVE FUEL FOR DIESEL ENGINES ROY CHOUDHURY BHASKAR (IN) 2005-03-24 WO disclosed