SCHEMBL3343066

SCHEMBL3343066

C=CC(=O)N(CCCC)CCP(=O)(O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 2/20 0.49
ZDHHC2 Q9UIJ5 1/20 0.49
MMP1 P03956 1/20 0.49
MMP2 P08253 1/20 0.49
MMP3 P08254 1/20 0.49
MMP8 P22894 1/20 0.49
LPAR3 Q9UBY5 3/20 0.41
LPAR2 Q9HBW0 1/20 0.41
S1PR2 O95136 7/20 0.41
S1PR1 P21453 7/20 0.41
S1PR3 Q99500 7/20 0.41
S1PR5 Q9H228 2/20 0.41
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA9 Q16790 2/20 0.39
S1PR4 O95977 6/20 0.35
GABBR2 O75899 1/20 0.34
GABRR1 P24046 1/20 0.34
GABBR1 Q9UBS5 1/20 0.34
HPGD P15428 1/20 0.33

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
SCHEMBL13304193 0.94 ZDHHC20 (0.57) ZDHHC20ZDHHC2MMP1MMP2MMP3
SCHEMBL13304196 0.94 ZDHHC20 (0.57) ZDHHC20ZDHHC2MMP1MMP2MMP3
SCHEMBL345353 0.86 ZDHHC20 (0.61) ZDHHC20ZDHHC2MMP1MMP2MMP3
SCHEMBL21092202 0.84 ZDHHC20 (0.44) ZDHHC20ZDHHC2MMP1MMP2MMP3
SCHEMBL23421424 0.84 ZDHHC20 (0.59) ZDHHC20ZDHHC2MMP1MMP2MMP3
SCHEMBL23421038 0.84 ZDHHC20 (0.59) ZDHHC20ZDHHC2MMP1MMP2MMP3
SCHEMBL23421169 0.84 ZDHHC20 (0.64) ZDHHC20ZDHHC2MMP1MMP2MMP3
SCHEMBL21091775 0.83 ZDHHC20 (0.43) ZDHHC20ZDHHC2MMP1MMP2MMP3
SCHEMBL23420808 0.82 ZDHHC20 (0.67) ZDHHC20ZDHHC2MMP1MMP2MMP3
SCHEMBL4577787 0.82 ZDHHC20 (0.57) ZDHHC20ZDHHC2MMP1MMP2MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11826446-B2 Oral care compositions comprising phosphonate and anionic group containing polymers THE PROCTER & GAMBLE COMPANY (US) 2023-11-28 US disclosed
US-11370863-B2 Oral care compositions comprising phosphono-phosphate and anionic group containing polymers THE PROCTER & GAMBLE COMPANY (US) 2022-06-28 US disclosed
US-11198763-B2 Oral care compositions comprising phosphono-phosphate and anionic group containing polymers THE PROCTER & GAMBLE COMPANY (US) 2021-12-14 US disclosed
US-11197814-B2 Oral care compositions comprising phosphonate and anionic group containing polymers THE PROCTER & GAMBLE COMPANY (US) 2021-12-14 US disclosed
US-11046798-B2 Phosphono-phosphate containing compounds and polymers THE PROCTER & GAMBLE COMPANY (US) 2021-06-29 US disclosed
US-20210052482-A1 ORAL CARE COMPOSITIONS COMPRISING PHOSPHONATE AND ANIONIC GROUP CONTAINING POLYMERS PROCTER & GAMBLE (US) 2021-02-25 US disclosed
US-20210047475-A1 ORAL CARE COMPOSITIONS COMPRISING PHOSPHONO-PHOSPHATE AND ANIONIC GROUP CONTAINING POLYMERS PROCTER & GAMBLE (US) 2021-02-18 US disclosed
EP-3723703-A1 ORAL CARE COMPOSITIONS COMPRISING PHOSPHONATE AND ANIONIC GROUP CONTAINING POLYMERS The Procter & Gamble Company (US) 2020-10-21 EP disclosed
WO-2019118414-A1 ORAL CARE COMPOSITIONS COMPRISING PHOSPHONATE AND ANIONIC GROUP CONTAINING POLYMERS THE PROCTER & GAMBLE COMPANY (US) 2019-06-20 WO disclosed
US-20190177456-A1 Phosphono-Phosphate Containing Compounds And Polymers THE PROCTER & GAMBLE COMPANY 2019-06-13 US disclosed
US-20100160485-A1 Hydrolysis stable self-etching, self-priming adhesive KLEE JOACHIM 2010-06-24 US disclosed
US-20100160485-A1 Hydrolysis stable self-etching, self-priming adhesive KLEE JOACHIM 2010-06-24 US disclosed
US-20100160485-A1 Hydrolysis stable self-etching, self-priming adhesive KLEE JOACHIM 2010-06-24 US disclosed
US-20080194730-A1 Hydrolysis stable self-etching, self-priming adhesive KLEE JOACHIM 2008-08-14 US disclosed
US-20080194730-A1 Hydrolysis stable self-etching, self-priming adhesive KLEE JOACHIM 2008-08-14 US disclosed
US-20080194730-A1 Hydrolysis stable self-etching, self-priming adhesive KLEE JOACHIM 2008-08-14 US disclosed
EP-1437999-B1 HYDROLYSIS STABLE SELF-ETCHING, SELF-PRIMING ADHESIVE DENTSPLY DETREY GMBH (DE) 2006-12-20 EP disclosed
US-20040266906-A1 Hydrolysis stable self-etching,self-priming adhesive KLEE JOACHIM (DE) 2004-12-30 US disclosed
EP-1437999-A1 HYDROLYSIS STABLE SELF-ETCHING, SELF-PRIMING ADHESIVE DENTSPLY DETREY GmbH (DE) 2004-07-21 EP disclosed
WO-2003035013-A1 HYDROLYSIS STABLE SELF-ETCHING, SELF-PRIMING ADHESIVE DENTSPLY DETREY GMBH (DE) 2003-05-01 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210047475-A1 ORAL CARE COMPOSITIONS COMPRISING PHOSPHONO-PHOSPHATE AND ANIONIC GROUP CONTAINING POLYMERS PHOSPHO1, PHPT1, INPP5D ZDHHC20 3506/4885ZDHHC2 4567/4885MMP1 2946/4885
US-20190177456-A1 Phosphono-Phosphate Containing Compounds And Polymers PHPT1, PHOSPHO1, PPIP5K2 ZDHHC20 4202/4885ZDHHC2 4589/4885MMP1 1791/4885
US-20080194730-A1 Hydrolysis stable self-etching, self-priming adhesive PPA1, PHOSPHO1, PDAP1 ZDHHC20 4120/4885ZDHHC2 4146/4885MMP1 497/4885
US-11198763-B2 Oral care compositions comprising phosphono-phosphate and anionic group containing polymers PHOSPHO1, PHPT1, INPP5D ZDHHC20 3506/4885ZDHHC2 4567/4885MMP1 2946/4885
US-20210052482-A1 ORAL CARE COMPOSITIONS COMPRISING PHOSPHONATE AND ANIONIC GROUP CONTAINING POLYMERS PHOSPHO1, PHPT1, DSC1 ZDHHC20 3778/4885ZDHHC2 4670/4885MMP1 3267/4885
US-11046798-B2 Phosphono-phosphate containing compounds and polymers PHPT1, PHOSPHO1, PPIP5K2 ZDHHC20 4202/4885ZDHHC2 4589/4885MMP1 1791/4885
US-11370863-B2 Oral care compositions comprising phosphono-phosphate and anionic group containing polymers PHOSPHO1, PHPT1, INPP5D ZDHHC20 3506/4885ZDHHC2 4567/4885MMP1 2946/4885
US-20100160485-A1 Hydrolysis stable self-etching, self-priming adhesive PPA1, PHOSPHO1, PDAP1 ZDHHC20 4120/4885ZDHHC2 4146/4885MMP1 497/4885
US-11197814-B2 Oral care compositions comprising phosphonate and anionic group containing polymers PHOSPHO1, PHPT1, DSC1 ZDHHC20 3778/4885ZDHHC2 4670/4885MMP1 3267/4885
US-11826446-B2 Oral care compositions comprising phosphonate and anionic group containing polymers PHOSPHO1, PHPT1, DSC1 ZDHHC20 3778/4885ZDHHC2 4670/4885MMP1 3267/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.