SCHEMBL2467729

SCHEMBL2467729

O=[PH](O)OCCCCCCO[PH](=O)O

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 3/20 0.32
LPAR1 Q92633 2/20 0.32
LPAR2 Q9HBW0 2/20 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
SCHEMBL11744958 1.00 LPAR3 (0.32) LPAR3LPAR1LPAR2
SCHEMBL1500471 1.00 LPAR3 (0.32) LPAR3LPAR1LPAR2
SCHEMBL17061016 1.00 LPAR3 (0.32) LPAR3LPAR1LPAR2
SCHEMBL902387 0.97
SCHEMBL1070729 0.90
SCHEMBL27952967 0.89 GAA (0.35)
SCHEMBL28716831 0.89 GAA (0.35)
SCHEMBL12835428 0.89 GAA (0.35)
Cyclohexane SCHEMBL19437666 0.88
SCHEMBL10946192 0.88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115215449-A Inhibitor for calcium oxalate scale in wide pH value range 济源市清源水处理有限公司 2022-10-21 CN disclosed
CN-105102447-A Bicyclic substituted pyrimidine PDE-5 inhibitor prodrug XUANZHU PHARMA CO LTD 2015-11-25 CN disclosed
US-20140336089-A1 Scale Inhibitor CLARIANT FINANCE (BVI) LIMITED (VG) 2014-11-13 US disclosed
US-8822390-B2 Scale inhibitor CLARIANT FINANCE (BVI) LIMITED (VG) 2014-09-02 US disclosed
EP-2371923-B1 Scale inhibitor CLARIANT FINANCE BVI LTD (VG) 2013-02-13 EP disclosed
US-20130023449-A1 Scale Inhibitor CLARIANT FINANCE (BVI) LIMITED (VG) 2013-01-24 US disclosed
EP-2371923-A1 Scale inhibitor Clariant International Ltd. (CH) 2011-10-05 EP disclosed
US-6811723-B1 MIXING WITH POLYETHYLENE PHOSPHATE ALKYL ETHERS; HYDROLYSIS OF TITANIUM COMPOUND IN PRESENCE OF CARBOXYLIC ACID HAVING AMINE OR HYDROXY GROUP(S); SILICON OR METAL OXIDE, HYDROXIDE, OR OXYHYDROXIDE COVERING ON PARTICLE RHODIA CHIMIE (FR) 2004-11-02 US disclosed
EP-0700874-B1 Hexamethylene phosphonate concentrate SOLUTIA EUROP NV SA (BE) 2001-05-30 EP disclosed
EP-0700874-B1 Hexamethylene phosphonate concentrate SOLUTIA EUROP NV SA (BE) 2001-05-30 EP disclosed
US-5606106-A CONCENTRATED AQUEOUS STORAGE STABLE SOLUTION MONSANTO EUROPE S.A. (BE) 1997-02-25 US disclosed
EP-0700874-A1 Hexamethylene phosphonate concentrate MONSANTO EUROPE S.A./N.V. (BE) 1996-03-13 EP disclosed
EP-0700874-A1 Hexamethylene phosphonate concentrate MONSANTO EUROPE S.A./N.V. (BE) 1996-03-13 EP disclosed
US-4057664-A Process for the production of quick-curing epoxide resin coatings which are resistant to chemicals and to weathering CIBA-GEIGY CORPORATION (US) 1977-11-08 US disclosed