SCHEMBL7608399

SCHEMBL7608399

CCCCCCOOP(=S)(OCC)OCC

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 16/20 0.48
LPAR2 Q9HBW0 13/20 0.48
LPAR1 Q92633 11/20 0.41
LPAR6 P43657 5/20 0.38
LPAR4 Q99677 5/20 0.38
LPAR5 Q9H1C0 5/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34

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
SCHEMBL7609299 0.81 LPAR3 (0.59) LPAR3LPAR2LPAR1LPAR6LPAR4
SCHEMBL8445228 0.81 LPAR3 (0.55) LPAR3LPAR2LPAR1LPAR6LPAR4
SCHEMBL11705375 0.80 LPAR3 (0.48) LPAR3LPAR2LPAR1LPAR6LPAR4
SCHEMBL258378 0.73 LPAR3 (0.67) LPAR3LPAR2LPAR1LPAR6LPAR4
SCHEMBL40063 0.73 LPAR3 (0.67) LPAR3LPAR2LPAR1LPAR6LPAR4
SCHEMBL258188 0.73 LPAR3 (0.67) LPAR3LPAR2LPAR1LPAR6LPAR4
SCHEMBL258249 0.73 LPAR3 (0.67) LPAR3LPAR2LPAR1LPAR6LPAR4
SCHEMBL258534 0.73 LPAR3 (0.67) LPAR3LPAR2LPAR1LPAR6LPAR4
SCHEMBL3557682 0.73 LPAR3 (0.67) LPAR3LPAR2LPAR1LPAR6LPAR4
SCHEMBL284021 0.73 LPAR3 (0.67) LPAR3LPAR2LPAR1LPAR6LPAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0951571-B1 FLUID EXTRACTION OF METALS OR METALLOIDS IDAHO RES FOUND (US) 2002-11-27 EP disclosed
EP-0951571-A1 FLUID EXTRACTION OF METALS OR METALLOIDS IDAHO RESEARCH FOUNDATION, INC. (US) 1999-10-27 EP disclosed
US-5840193-A Fluid extraction using carbon dioxide and organophosphorus chelating agents IDAHO RESEARCH FOUNDATION (US) 1998-11-24 US disclosed
WO-1998004753-A1 FLUID EXTRACTION OF METALS OR METALLOIDS IDAHO RESEARCH FOUNDATION, INC. (US) 1998-02-05 WO disclosed