SCHEMBL5455779

SCHEMBL5455779

CC(C)(CN)OP(=O)(O)OP(=O)(O)O

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 4/20 0.42
FDPS P14324 2/20 0.38
BLM P54132 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MVD P53602 4/20 0.36
SMPD1 P17405 2/20 0.32
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32
PGGT1B P53609 1/20 0.32

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
SCHEMBL1421419 0.84 SMPD1 (0.39) FDPSBLMTDP1SMPD1
SCHEMBL28766325 0.83 BTN3A1 (0.42) BTN3A1FDPSBLMTDP1MVD
SCHEMBL28587117 0.79 BTN3A1 (0.40) BTN3A1FDPSBLMTDP1MVD
SCHEMBL2871051 0.77 FDPS (0.45) BTN3A1FDPSBLMTDP1MVD
SCHEMBL4419907 0.76 SMPD1 (0.44) BTN3A1FDPSSMPD1
SCHEMBL12234256 0.73 FDPS (0.41) BTN3A1FDPSBLMTDP1MVD
SCHEMBL2122912 0.72 BTN3A1 (0.40) BTN3A1FDPSBLMTDP1MVD
Hydrochloric Acid SCHEMBL28697610 0.71 FDPS (0.39) BTN3A1FDPSBLMTDP1MVD
SCHEMBL6706861 0.71 BTN3A1 (0.39) BTN3A1FDPSBLMTDP1MVD
SCHEMBL5459582 0.71 FDPS (0.35) BTN3A1FDPSBLMTDP1SMPD1

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
US-20070210476-A1 Machinable Resin Molded Product, Material For Forming The Same, And Model Made Of The Same SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2007-09-13 US disclosed
EP-1728832-A1 MOLDING OF RESIN FOR CUTTING OPERATION, MATERIAL FOR FORMATION THEREOF AND MODEL Sanyo Chemical Industries, Ltd. (JP) 2006-12-06 EP disclosed