SCHEMBL7608166

SCHEMBL7608166

CCCCCCC(CC)(P(=O)(O)O)P(=O)(O)OCC

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 7/20 0.65
FDPS P14324 10/20 0.49
LPAR3 Q9UBY5 4/20 0.47
SMPD1 P17405 3/20 0.47
LPAR1 Q92633 3/20 0.47
LPAR2 Q9HBW0 2/20 0.46

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
Phosphoric Acid SCHEMBL27558355 0.82 GGPS1 (0.80) GGPS1FDPSLPAR3SMPD1LPAR1
SCHEMBL5066684 0.82 GGPS1 (0.79) GGPS1FDPSLPAR3SMPD1LPAR1
SCHEMBL15876463 0.80 GGPS1 (1.00) GGPS1FDPSLPAR3SMPD1LPAR1
SCHEMBL10486919 0.80 GGPS1 (1.00) GGPS1FDPSLPAR3SMPD1LPAR1
SCHEMBL9444830 0.76 GGPS1 (0.46) GGPS1FDPSLPAR3SMPD1LPAR1
SCHEMBL3630921 0.74 GGPS1 (0.43) GGPS1FDPSLPAR3LPAR1LPAR2
Heptane SCHEMBL5657 0.73 LPAR3 (0.71) LPAR3SMPD1LPAR1LPAR2
Hydrochloric Acid SCHEMBL27340119 0.72 GGPS1 (0.42) GGPS1FDPSLPAR3LPAR1LPAR2
Fluoride SCHEMBL27874297 0.72 GGPS1 (0.42) GGPS1FDPSLPAR3LPAR1LPAR2
Hexane SCHEMBL10371616 0.71 LPAR3 (0.67) LPAR3SMPD1LPAR1LPAR2

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-0830190-B1 METHOD FOR THE CHROMATOGRAPHIC SEPARATION OF CATIONS FROM AQUEOUS SAMPLES ARCH DEV CORP (US) 2002-04-24 EP disclosed
EP-0830190-A4 METHOD FOR THE CHROMATOGRAPHIC SEPARATION OF CATIONS FROM AQUEOUS SAMPLES ARCH DEV CORP (US) 1999-01-13 EP disclosed
EP-0830190-A1 METHOD FOR THE CHROMATOGRAPHIC SEPARATION OF CATIONS FROM AQUEOUS SAMPLES ARCH DEVELOPMENT CORPORATION (US) 1998-03-25 EP disclosed
WO-1996039238-A1 METHOD FOR THE CHROMATOGRAPHIC SEPARATION OF CATIONS FROM AQUEOUS SAMPLES ARCH DEVELOPMENT CORPORATION (US) 1996-12-12 WO disclosed