SCHEMBL2242184

SCHEMBL2242184

CCCOC(=O)C(C)(C)P(=O)(O)O

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FDPS P14324 6/20 0.39
HCAR2 Q8TDS4 1/20 0.35
SMPD1 P17405 2/20 0.34
ALDH1A1 P00352 2/20 0.34
LMNA P02545 1/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP9 P14780 1/20 0.33
LPAR3 Q9UBY5 3/20 0.32
LPAR1 Q92633 2/20 0.32
LPAR2 Q9HBW0 2/20 0.32
GGPS1 O95749 2/20 0.32
ESR1 P03372 1/20 0.32
CHRM1 P11229 1/20 0.32
TSHR P16473 1/20 0.32
SLC6A2 P23975 1/20 0.32
KDR P35968 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL2240367 0.88 ALDH1A1 (0.47) FDPSHCAR2SMPD1ALDH1A1LPAR3
SCHEMBL21626211 0.84 FDPS (0.36) FDPSHCAR2SMPD1ALDH1A1LMNA
SCHEMBL1450701 0.83 CYP4F2 (0.41) FDPSALDH1A1LMNATSHR
SCHEMBL2238606 0.80 FDPS (0.42) FDPSHCAR2SMPD1LMNALPAR3
SCHEMBL6055674 0.80 LPAR3 (0.34) FDPSHCAR2ALDH1A1LMNALPAR3
SCHEMBL4672465 0.78 HCAR2 (0.40) HCAR2ALDH1A1LMNAESR1CHRM1
SCHEMBL2242038 0.78 LPAR3 (0.35) FDPSHCAR2ALDH1A1LMNALPAR3
SCHEMBL2687507 0.76 CYP4F2 (0.33) FDPSHCAR2ALDH1A1LMNALPAR3
SCHEMBL2237879 0.76 FDPS (0.42) FDPSHCAR2SMPD1LPAR3LPAR1
SCHEMBL204763 0.75 POLB (0.44) HCAR2ALDH1A1LMNAESR1CHRM1

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 130 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4829109-B2 2011-12-07 JP claimed
JP-4338975-B2 2009-10-07 JP claimed
EP-1554330-B1 PARTIALLY ESTER-EXCHANGED SIPM AND PROCESS THEREWITH INVISTA TECH SARL (CH) 2009-03-11 EP claimed
EP-1373359-A4 METAL-CONTAINING COMPOSITION AND PROCESS THEREWITH DU PONT (US) 2008-08-20 EP claimed
EP-1615934-B1 TITANIUM CHELATE DISPERSIONS DU PONT (US) 2007-06-27 EP claimed
EP-1669388-A1 Process for producing copolymers comprising isophthalic acid E.I.Du pont de nemours and company (US) 2006-06-14 EP claimed
US-7049376-B2 Catalyst composition and process therewith E. I. DU PONT DE NEMOURS AND COMPANY (US) 2006-05-23 US claimed
US-6998462-B2 esterification, ester interchange, and/or condensation polymerization of dicarboxylic acids or esters with alcohols in the presence of catalysts; catalysis E.I. DU PONT DE NEMOURS AND COMPANY (US) 2006-02-14 US claimed
EP-1615934-A2 TITANIUM CHELATE DISPERSIONS E.I. DUPONT DE NEMOURS AND COMPANY (US) 2006-01-18 EP claimed
US-20050182237-A1 Catalyst composition and process therewith E. I. DU PONT DE NEMOURS AND COMPANY 2005-08-18 US claimed
US-6489433-B2 A COMPLEX IS FORMED BY COMBINING A TITANIUM COMPOUND; A COMPONENT SELECTED FROM THE GROUP CONSISTING OF A COMPLEXING AGENT, OR A COMBINATION OF COMPLEXING AGENT, HYPOPHOSPHORUS ACID OR SALT; A PHOSPHORUS COMPOUND E. I. DU PONT DE NEMOURS AND COMPANY 2002-12-03 US claimed
US-20020169273-A1 Sulfoisophthalic acid solution and process therewith E. I. DU PONT DE NEMOURS AND COMPANY 2002-11-14 US claimed
US-6479619-B1 PRODUCING A PARTIALLY ESTERIFIED ALKALI METAL SULFOISOPHTHALIC ACID IN A GLYCOL; CAN BE MADE IMMEDIATELY PRIOR TO USE; COPOLYMERIZING WITH TEREPHTHALIC ACID AND A GLYCOL TO FORM A POLYESTER E. I. DU PONT DE NEMOURS AND COMPANY 2002-11-12 US claimed
US-20020165336-A1 COMPOSITION COMPRISING TITANIUM AND PROCESS THEREWITH E. I. DU PONT DE NEMOURS AND COMPANY 2002-11-07 US claimed
WO-2002074834-A1 SULFOISOPHTHALIC ACID SOLUTION AND PROCESS THEREWITH E. I. DU PONT DE NEMOURS AND COMPANY (US) 2002-09-26 WO claimed
WO-2002070451-A1 SOPHTHALIC ACID GLYCOL ESTER SOLUTION E. I. DU PONT DE NEMOURS AND COMPANY (US) 2002-09-12 WO claimed
WO-2002068497-A1 METAL-CONTAINING COMPOSITION AND PROCESS THEREWITH E.I. DU PONT DE NEMOURS AND COMPANY (US) 2002-09-06 WO claimed
US-20020120094-A1 Copolymer comprising isophthalic acid INVISTA NORTH AMERICA S.A.R.L. 2002-08-29 US claimed
WO-2002058843-A1 CATALYST COMPOSITION AND PROCESS THEREWITH E. I. DU PONT DE NEMOURS AND COMPANY (US) 2002-08-01 WO claimed
US-20020098972-A1 Catalyst composition and process therewith DORF KETAL SPECIALITY CATALYSTS, LLC 2002-07-25 US claimed