SCHEMBL9754051

SCHEMBL9754051

CCCCCCSP(=O)(S)OCC.[Zn]

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 3/20 0.37
LPAR1 Q92633 2/20 0.37
LPAR2 Q9HBW0 2/20 0.37
FDPS P14324 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
SCHEMBL11699342 0.98 LPAR3 (0.38) LPAR3LPAR1LPAR2
SCHEMBL11694816 0.98 LPAR3 (0.38) LPAR3LPAR1LPAR2
SCHEMBL11124791 0.96 TSHR (0.36) LPAR3LPAR1LPAR2
SCHEMBL11695523 0.90 TSHR (0.37) FDPS
SCHEMBL345958 0.87 LPAR3 (0.48) LPAR3LPAR1LPAR2
SCHEMBL11145204 0.87 CYP3A4 (0.45) LPAR3LPAR1LPAR2
SCHEMBL345931 0.87 LPAR3 (0.48) LPAR3LPAR1LPAR2
SCHEMBL21044742 0.87 LPAR3 (0.48) LPAR3LPAR1LPAR2
SCHEMBL20791915 0.87 CYP3A4 (0.45) LPAR3LPAR1LPAR2
SCHEMBL164249 0.87 LPAR3 (0.48) LPAR3LPAR1LPAR2

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-1991017226-A2 STABILIZERS USEFUL WITH COMPOSITIONS OF 1,1-DICHLORO-2,2,2-TRIFLUOROETHANE AND HYDROGEN-CONTRIBUTING COMPOUNDS ALLIED-SIGNAL INC. (US) 1991-11-14 WO disclosed