SCHEMBL3909276

SCHEMBL3909276

CCCCCI.CCCCCI.O=P(O)(O)F

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 4/20 0.46
LPAR3 Q9UBY5 7/20 0.46
LPAR2 Q9HBW0 3/20 0.46
LPAR1 Q92633 3/20 0.43
FDPS P14324 10/20 0.43
FAAH O00519 1/20 0.40
LAP3 P28838 1/20 0.40

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
Hexane SCHEMBL28170879 0.87 LPAR3 (0.57) GGPS1LPAR3LPAR2LPAR1FDPS
SCHEMBL3909282 0.84 LPAR3 (0.47) GGPS1LPAR3LPAR2LPAR1FDPS
Hexane SCHEMBL30413125 0.84 LPAR3 (0.55) GGPS1LPAR3LPAR2LPAR1FDPS
Octane SCHEMBL3825127 0.84 LPAR3 (0.62) GGPS1LPAR3LPAR2LPAR1FDPS
Phosphoric Acid SCHEMBL9495746 0.81 GGPS1 (0.46) GGPS1LPAR3LPAR2LPAR1FDPS
Heptane SCHEMBL29462261 0.78 LPAR3 (0.62) GGPS1LPAR3LPAR2LPAR1FDPS
SCHEMBL30324 0.78
SCHEMBL1414393 0.78
SCHEMBL11216567 0.75
SCHEMBL3875770 0.75 LPAR3 (0.46) GGPS1LPAR3LPAR2LPAR1FDPS

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-7579390-B2 Inkjet ink composition and printed matters created using inkjet ink composition TOSHIBA TEC KABUSHIKI KAISHA (JP) 2009-08-25 US claimed