SCHEMBL6012146

SCHEMBL6012146

CCCCCC(CCCCC)CCCCP(=O)(O)O

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LPAR3 Q9UBY5 3/20 0.71
▸ LPAR2 Q9HBW0 1/20 0.71
▸ FDPS P14324 4/20 0.59
▸ S1PR2 O95136 11/20 0.58
▸ S1PR1 P21453 11/20 0.58
▸ S1PR3 Q99500 11/20 0.58
▸ S1PR4 O95977 9/20 0.58
▸ LAP3 P28838 2/20 0.55
▸ S1PR5 Q9H228 2/20 0.52

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
SCHEMBL11406656 0.98 LPAR3 (0.75) LPAR3LPAR2FDPSS1PR2S1PR1
SCHEMBL22605995 0.94 LPAR3 (0.69) LPAR3LPAR2FDPSS1PR2S1PR1
SCHEMBL23962438 0.89 S1PR2 (0.67) LPAR3LPAR2FDPSS1PR2S1PR1
SCHEMBL4427365 0.89 LPAR3 (0.60) LPAR3LPAR2FDPSS1PR2S1PR1
SCHEMBL22291102 0.88 LPAR3 (0.67) LPAR3LPAR2FDPSS1PR2S1PR1
SCHEMBL11730 0.86 — —
Hexane SCHEMBL5583931 0.86 LPAR3 (0.94) LPAR3LPAR2FDPSS1PR2S1PR1
SCHEMBL2775267 0.86 LPAR3 (0.63) LPAR3LPAR2FDPSS1PR2S1PR1
SCHEMBL31037551 0.84 LPAR3 (0.61) LPAR3LPAR2FDPSS1PR2S1PR1
Phosphoric Acid SCHEMBL11044191 0.84 FDPS (0.60) FDPSS1PR2S1PR1S1PR3S1PR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1499412-B1 PRODUCTION OF ULTRAPURE RADIONUCLIDES BY MEANS OF MULTICOLUMN SELECTIVITY INVERSION GENERATOR PG RES FOUNDATION (US) 2014-06-11 — — EP disclosed
US-6998052-B2 Multicolumn selectivity inversion generator for production of ultrapure radionuclides PG RESEARCH FOUNDATION (US) 2006-02-14 — — US disclosed
US-20030219366-A1 Multicolumn selectivity inversion generator for production of ultrapure radionuclides PG RESEARCH FOUNDATION 2003-11-27 — — US disclosed
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