SCHEMBL328945

SCHEMBL328945

O=P(O)(O)C(CCCCCCO)P(=O)(O)O

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FDPS P14324 6/20 0.64
LAP3 P28838 1/20 0.39
PTPN1 P18031 1/20 0.37

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
SCHEMBL5832092 1.00 FDPS (0.64) FDPSLAP3PTPN1
SCHEMBL11320226 1.00 FDPS (0.64) FDPSLAP3PTPN1
SCHEMBL6239566 1.00 FDPS (0.64) FDPSLAP3PTPN1
SCHEMBL5011539 0.97 FDPS (0.62) FDPSLAP3
SCHEMBL3854503 0.90 FDPS (0.61) FDPSPTPN1
SCHEMBL10863085 0.89 FDPS (0.76) FDPSLAP3
SCHEMBL20699855 0.87 FDPS (0.75) FDPSLAP3
Water SCHEMBL7060881 0.85 FDPS (0.56) FDPSPTPN1
SCHEMBL8010559 0.85 FDPS (0.48) FDPS
SCHEMBL2321372 0.81 FDPS (0.70) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8404144-B2 Compositions including polymerizable bisphosphonic acids and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-03-26 US disclosed
EP-2407142-A1 Use of polymerizable bisphosphonic acids for the treatment of tooth surfaces that are not pretreated with phosphoric acid 3M Innovative Properties Company (US) 2012-01-18 EP disclosed
US-20090075239-A1 COMPOSITIONS INCLUDING POLYMERIZABLE BISPHOSPHONIC ACIDS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY 2009-03-19 US disclosed
EP-1578377-A1 COMPOSITIONS INCLUDING POLYMERIZABLE BISPHOSPHONIC ACIDS AND METHODS 3M Innovative Properties Company (US) 2005-09-28 EP disclosed
US-20040206932-A1 Compositions including polymerizable bisphosphonic acids and methods 3M INNOVATIVE PROPERTIES COMPANY 2004-10-21 US disclosed
WO-2004060327-A1 COMPOSITIONS INCLUDING POLYMERIZABLE BISPHOSPHONIC ACIDS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2004-07-22 WO disclosed