SCHEMBL1137735

SCHEMBL1137735

C=C(CCOP(=O)(O)OCCC(=C)C(=O)O)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ BTN3A1 O00481 1/20 0.46
▸ PEPD P12955 1/20 0.37
▸ MVD P53602 3/20 0.34
▸ PGK1 P00558 1/20 0.33
▸ PGK2 P07205 1/20 0.33
▸ TSHR P16473 1/20 0.32
▸ TET2 Q6N021 3/20 0.31
▸ TET3 O43151 1/20 0.31
▸ TET1 Q8NFU7 1/20 0.31
▸ P2RY10 O00398 4/20 0.31
▸ GPR34 Q9UPC5 2/20 0.31
▸ GRIK1 P39086 1/20 0.30
▸ GRIK2 Q13002 1/20 0.30
▸ GRM1 Q13255 1/20 0.30
▸ GRM2 Q14416 1/20 0.30
▸ ALOX15 P16050 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30

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
SCHEMBL1138195 0.88 BTN3A1 (0.39) BTN3A1PEPDMVDPGK1PGK2
SCHEMBL830037 0.87 PGK1 (0.42) BTN3A1PEPDMVDPGK1PGK2
SCHEMBL21839361 0.83 TSHR (0.44) BTN3A1TSHRALOX15HSD17B10
SCHEMBL1139628 0.80 CYP3A4 (0.42) BTN3A1P2RY10GPR34
SCHEMBL472232 0.77 BTN3A1 (0.54) BTN3A1PEPDMVD
Diethyl Hydrogen Phosphate SCHEMBL1139003 0.76 PPARD (0.34) BTN3A1PEPDTSHRP2RY10GPR34
SCHEMBL8457807 0.76 FABP3 (0.43) BTN3A1P2RY10GPR34
SCHEMBL270866 0.75 LPAR3 (0.44) BTN3A1PEPDPGK1PGK2
SCHEMBL164574 0.75 — —
SCHEMBL9436946 0.74 TET2 (0.37) TSHRTET2TET3TET1GRIK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11998622-B2 Dental cement compositions and methods of use ZEST IP HOLDINGS, LLC (US) 2024-06-04 — — US claimed
US-20210038482-A1 DENTAL CEMENT COMPOSITIONS AND METHODS OF USE ZEST IP HOLDINGS, LLC 2021-02-11 — — US claimed
EP-1541333-A1 Scratch resistant moisture-protecting parylene layers Agfa-Gevaert (BE) 2005-06-15 — — EP claimed
US-20050067584-A1 Scratch resistant moisture-protecting parylene layers AGFA NV (BE) 2005-03-31 — — US claimed
US-20240052079-A1 ANTIBACTERIAL ESTER-FREE MONOMERS FOR DENTAL ADHESIVES NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2024-02-15 — — US disclosed
US-11180595-B2 Copolymer having carbosiloxane dendrimer structure and acidic group, composition containing same, and cosmetic DOW TORAY CO., LTD. (JP) 2021-11-23 — — US disclosed
US-20210038482-A1 DENTAL CEMENT COMPOSITIONS AND METHODS OF USE ZEST IP HOLDINGS, LLC 2021-02-11 — — US disclosed
US-10751263-B2 Dental cement compositions and methods of use ZEST IP HOLDINGS, LLC (US) 2020-08-25 — — US disclosed
US-20180289593-A1 DENTAL CEMENT COMPOSITIONS AND METHODS OF USE ZEST IP HOLDINGS, LLC 2018-10-11 — — US disclosed
EP-2824124-A1 Polymeric dispersing agent BASF SE (DE) 2015-01-14 — — EP disclosed
EP-1803433-B2 One-component dental adhesive composition and method of use KERR CORP (US) 2014-03-26 — — EP disclosed
EP-1767504-B1 PHOSPHORIC ESTER POLYMER KAO CORP (JP) 2013-09-18 — — EP disclosed
EP-1923409-A1 METHOD FOR PRODUCING PHOSPHATE POLYMER Kao Corporation (JP) 2008-05-21 — — EP disclosed
US-20070155853-A1 One-component dental adhesive compositions and method of use KERR CORPORATION 2007-07-05 — — US disclosed
EP-1803433-A2 One-component dental adhesive composition and method of use Kerr Corporation (US) 2007-07-04 — — EP disclosed
EP-1767504-A1 PHOSPHORIC ESTER POLYMER Kao Corporation (JP) 2007-03-28 — — EP disclosed
US-7193226-B2 Scratch resistant moisture-protecting parylene layers AGFA-GEVAERT (BE) 2007-03-20 — — US disclosed
EP-1743877-A1 Dispersant for hydraulic composition Kao Corporation (JP) 2007-01-17 — — EP disclosed
EP-1541333-A1 Scratch resistant moisture-protecting parylene layers Agfa-Gevaert (BE) 2005-06-15 — — EP disclosed
US-20050067584-A1 Scratch resistant moisture-protecting parylene layers AGFA NV (BE) 2005-03-31 — — US 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 (6 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-20180289593-A1 DENTAL CEMENT COMPOSITIONS AND METHODS OF USE CALCOCO2, VCL, CDH1 BTN3A1 1268/4885PEPD 3042/4885MVD 1266/4885
US-10751263-B2 Dental cement compositions and methods of use CALCOCO2, VCL, CDH1 BTN3A1 1268/4885PEPD 3042/4885MVD 1266/4885
US-20240052079-A1 ANTIBACTERIAL ESTER-FREE MONOMERS FOR DENTAL ADHESIVES CDH1, ICAM1, CAD BTN3A1 1571/4885PEPD 3410/4885MVD 2320/4885
US-11998622-B2 Dental cement compositions and methods of use CALCOCO2, VCL, CDH1 BTN3A1 1268/4885PEPD 3042/4885MVD 1266/4885
US-20210038482-A1 DENTAL CEMENT COMPOSITIONS AND METHODS OF USE CALCOCO2, VCL, CDH1 BTN3A1 1268/4885PEPD 3042/4885MVD 1266/4885
US-11180595-B2 Copolymer having carbosiloxane dendrimer structure and acidic group, composition containing same, and cosmetic WASHC5, ADCY1, ADCY8 BTN3A1 1012/4885PEPD 4227/4885MVD 1554/4885

“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.

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