SCHEMBL1614430

SCHEMBL1614430

O=P(O)(O)C(N(CCCO)C(P(=O)(O)O)P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FDPS P14324 3/20 0.41
TYMS P04818 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
SCHEMBL12231136 0.92 FDPS (0.36) FDPS
SCHEMBL5162009 0.87 FDPS (0.46) FDPSTYMS
SCHEMBL449507 0.87 FDPS (0.46) FDPSTYMS
SCHEMBL12231190 0.87 FDPS (0.36) FDPS
SCHEMBL12231124 0.86 FDPS (0.35) FDPS
SCHEMBL10771002 0.85 FDPS (0.44) FDPSTYMS
SCHEMBL168236 0.85 FDPS (0.44) FDPS
SCHEMBL132769 0.85 FDPS (0.44) FDPSTYMS
SCHEMBL12231286 0.84 FDPS (0.34) FDPS
SCHEMBL12231174 0.83 FDPS (0.36) FDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9376650-B2 Method of water treatment ITALMATCH CHEMICALS SPA (IT) 2016-06-28 US disclosed
US-9296632-B2 Phosphonate compounds ITALMATCH CHEMICALS SPA (IT) 2016-03-29 US disclosed
EP-2716646-B1 Phosphonate compounds ITALMATCH CHEMICALS SPA (IT) 2015-06-10 EP disclosed
EP-2125844-B1 PHOSPHONATE COMPOUNDS ITALMATCH CHEMICALS SPA (IT) 2014-08-06 EP disclosed
US-8551931-B2 Surface treatment composition containing phosphonic acid compounds DEQUEST AG (CH) 2013-10-08 US disclosed
US-20110133116-A1 METHOD OF WATER TREATMENT DEQUEST AG (CH) 2011-06-09 US disclosed
US-20110086791-A1 SURFACE TREATMENT COMPOSITION CONTAINING PHOSPHONIC ACID COMPOUNDS DEQUEST AG (CH) 2011-04-14 US disclosed
US-20100145066-A1 PHOSPHONATE COMPOUNDS THERMPHOS TRADING GMBH (CH) 2010-06-10 US disclosed
EP-2082991-A1 Method of Water Treatment Thermphos Trading GmbH (CH) 2009-07-29 EP disclosed
EP-1932850-A1 Phosphonate compounds Thermphos Trading GmbH (CH) 2008-06-18 EP disclosed