SCHEMBL6424549

SCHEMBL6424549

CCCOP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 3/20 0.55
MVD P53602 4/20 0.47
LPAR3 Q9UBY5 4/20 0.42
LPAR1 Q92633 3/20 0.42
LPAR2 Q9HBW0 2/20 0.42
GGPS1 O95749 2/20 0.38
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38

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
SCHEMBL13133478 1.00 BTN3A1 (0.55) BTN3A1MVDLPAR3LPAR1LPAR2
SCHEMBL1542080 0.96 BTN3A1 (0.59) BTN3A1MVDLPAR3LPAR1LPAR2
SCHEMBL28234823 0.93 BTN3A1 (0.57) BTN3A1MVDLPAR3LPAR1LPAR2
SCHEMBL309468 0.91 BTN3A1 (0.47) BTN3A1MVDLPAR3LPAR1LPAR2
SCHEMBL18798621 0.88 LPAR3 (0.53) BTN3A1MVDLPAR3LPAR1LPAR2
SCHEMBL10935345 0.88 LPAR3 (0.53) BTN3A1MVDLPAR3LPAR1LPAR2
SCHEMBL29174378 0.86 BTN3A1 (0.57) BTN3A1MVDGGPS1FNTAFNTB
SCHEMBL27854174 0.86 LPAR3 (0.62) BTN3A1MVDLPAR3LPAR1LPAR2
SCHEMBL25212129 0.84 LPAR3 (0.60) BTN3A1MVDLPAR3LPAR1LPAR2
SCHEMBL6538444 0.84 LPAR3 (0.66) BTN3A1MVDLPAR3LPAR1LPAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1545555-A2 COMPOSITIONS AND METHODS FOR TREATING EPITHELIAL AND RETINAL TISSUE DISEASES Inspire Pharmaceuticals, Inc. (US) 2005-06-29 EP disclosed
WO-2003072067-A2 COMPOSITIONS AND METHODS FOR TREATING EPITHELIAL AND RETINAL TISSUE DISEASES INSPIRE PHARMACEUTICALS, INC. (US) 2003-09-04 WO disclosed