Dectaflur

Dectaflur

SCHEMBL11087909

CCCCCCCC/C=C\CCCCCCCCN.CCCCCCOP(O)(=S)OCCCCCC

nearest known ligand 0.69

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Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 13/20 0.69
LPAR2 Q9HBW0 10/20 0.69
LPAR1 Q92633 7/20 0.69
SLC6A5 Q9Y345 2/20 0.44
P2RY10 O00398 1/20 0.44

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
Dectaflur SCHEMBL11077288 0.97 LPAR3 (0.64) LPAR3LPAR2LPAR1SLC6A5P2RY10
SCHEMBL8468251 0.92 LPAR3 (0.80) LPAR3LPAR2LPAR1
Dodecylamine SCHEMBL11065806 0.90 LPAR3 (0.62) LPAR3LPAR2LPAR1
Dodecylamine SCHEMBL11084017 0.87 LPAR3 (0.57) LPAR3LPAR2LPAR1
Dectaflur SCHEMBL5448731 0.86 LPAR3 (0.61) LPAR3LPAR2LPAR1SLC6A5
SCHEMBL13355654 0.86 LPAR3 (0.71) LPAR3LPAR2LPAR1P2RY10
SCHEMBL13355657 0.86 LPAR3 (0.71) LPAR3LPAR2LPAR1P2RY10
SCHEMBL7125091 0.84 LPAR3 (0.64) LPAR3LPAR2LPAR1P2RY10
Dectaflur SCHEMBL11081566 0.84 LPAR3 (0.64) LPAR3LPAR2LPAR1P2RY10
Dectaflur SCHEMBL28112580 0.84 LPAR3 (0.79) LPAR3LPAR2LPAR1P2RY10

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-4431552-A EXTREME PRESSURE LUBRICANTS; WEAR RESISTANCE CHEVRON RESEARCH COMPANY (US) 1984-02-14 US disclosed