SCHEMBL890680

SCHEMBL890680

C=C(C)C(=O)OC(CCCCCCC)COP(=O)(O)O

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 6/20 0.51
ENPP2 Q13822 6/20 0.51
LPAR1 Q92633 6/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
PLA2G4A P47712 2/20 0.45
SGPL1 O95470 4/20 0.45
LPAR6 P43657 1/20 0.44
LPAR4 Q99677 1/20 0.44
LPAR5 Q9H1C0 1/20 0.44
LPAR2 Q9HBW0 1/20 0.44
S1PR1 P21453 1/20 0.44

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
SCHEMBL7094395 1.00 LPAR3 (0.51) LPAR3ENPP2LPAR1SMN1; SMN2PLA2G4A
SCHEMBL26109390 0.99 LPAR3 (0.49) LPAR3ENPP2LPAR1SMN1; SMN2PLA2G4A
SCHEMBL15752950 0.94 ENPP2 (0.47) LPAR3ENPP2LPAR1SMN1; SMN2PLA2G4A
Glycerin SCHEMBL31371481 0.93 LPAR3 (0.45) LPAR3ENPP2LPAR1SMN1; SMN2PLA2G4A
Monoethanolamine SCHEMBL31294588 0.93 LPAR3 (0.45) LPAR3ENPP2LPAR1SMN1; SMN2PLA2G4A
SCHEMBL12273806 0.92 PLA2G2A (0.47) LPAR3ENPP2LPAR1SMN1; SMN2
SCHEMBL2679164 0.89 LPAR3 (0.48) LPAR3ENPP2LPAR1SMN1; SMN2
SCHEMBL26105729 0.88 ENPP2 (0.43) LPAR3ENPP2LPAR1SMN1; SMN2LPAR6
SCHEMBL1890625 0.88 LPAR3 (0.57) LPAR3ENPP2LPAR1SMN1; SMN2LPAR5
SCHEMBL28364987 0.86 TSHR (0.48) LPAR3ENPP2LPAR1SMN1; SMN2LPAR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11992538-B2 Polymerizable dental composition based on condensed silanes VOCO GMBH (DE) 2024-05-28 US claimed
US-20210052469-A1 POLYMERIZABLE DENTAL COMPOSITION BASED ON CONDENSED SILANES VOCO GMBH (DE) 2021-02-25 US claimed
EP-3782599-A1 DENTAL POLYMERIZABLE COMPOSITION BASED ON CONDENSED SILANES VOCO GmbH (DE) 2021-02-24 EP claimed
US-11992538-B2 Polymerizable dental composition based on condensed silanes VOCO GMBH (DE) 2024-05-28 US disclosed
US-20210052469-A1 POLYMERIZABLE DENTAL COMPOSITION BASED ON CONDENSED SILANES VOCO GMBH (DE) 2021-02-25 US disclosed
EP-2578200-B1 Compounds for infiltrating and/or sealing of dental hard substance and method VOCO GMBH (DE) 2018-03-28 EP disclosed
US-9833387-B2 Kit and method for indirect chairside production of composite inlays VOCO GMBH (DE) 2017-12-05 US disclosed
EP-2436363-B1 Compound comprising a monomer with a polyalicyclic structure element for filling and/or sealing a root canal VOCO GMBH (DE) 2017-01-18 EP disclosed
US-9079828-B2 Polymerizable compounds comprising a polyalicylic structure element VOCO GMBH (DE) 2015-07-14 US disclosed
US-8979535-B2 Compositions for infiltration and/or sealing of hard tooth tissue and corresponding methods VOCO GMBH (DE) 2015-03-17 US disclosed
US-8915736-B2 Composition comprising a monomer with a polyalicyclic structure element for filling and/or sealing a root canal VOCO GMBH (DE) 2014-12-23 US disclosed
US-8697772-B2 Polymerizable phosphoric acid derivatives comprising a polyalicylic structure element VOCO GMBH (DE) 2014-04-15 US disclosed
EP-2578200-A1 Compounds for infiltrating and/or sealing of dental hard substance and method VOCO GmbH (DE) 2013-04-10 EP disclosed
US-20130084546-A1 COMPOSITIONS FOR INFILTRATION AND/OR SEALING OF HARD TOOTH TISSUE AND CORRESPONDING METHODS VOCO GMBH (DE) 2013-04-04 US disclosed
EP-2436668-B1 Polymerisable compounds comprising a polyalicyclic structure element VOCO GMBH (DE) 2012-09-12 EP disclosed
US-20120115108-A1 POLYMERIZABLE PHOSPHORIC ACID DERIVATIVES COMPRISING A POLYALICYLIC STRUCTURE ELEMENT VOCO GMBH (DE) 2012-05-10 US disclosed
EP-2450025-A1 Polymerisable phosphoric acid derivatives comprising a polyalicyclic structure element VOCO GmbH (DE) 2012-05-09 EP disclosed
US-20120082954-A1 Composition Comprising a Monomer with a Polyalicyclic Structure Element for Filling and/or Sealing a Root Canal VOCO GMBH (DE) 2012-04-05 US disclosed
US-20120082959-A1 Polymerizable Compounds Comprising a Polyalicylic Structure Element VOCO GMBH (DE) 2012-04-05 US disclosed
EP-2436668-A1 Polymerisable compounds comprising a polyalicyclic structure element VOCO GmbH (DE) 2012-04-04 EP 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 (5 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-11992538-B2 Polymerizable dental composition based on condensed silanes NCAPH, RCC1, NCAPD2 LPAR3 1042/4885ENPP2 4381/4885LPAR1 1832/4885
US-20130084546-A1 COMPOSITIONS FOR INFILTRATION AND/OR SEALING OF HARD TOOTH TISSUE AND CORRESPONDING METHODS ITGB3, RAB5IF, CIB1 LPAR3 4443/4885ENPP2 3479/4885LPAR1 4641/4885
US-20120082959-A1 Polymerizable Compounds Comprising a Polyalicylic Structure Element PCBP1, PUF60, PARG LPAR3 3723/4885ENPP2 2810/4885LPAR1 3948/4885
US-20210052469-A1 POLYMERIZABLE DENTAL COMPOSITION BASED ON CONDENSED SILANES NCAPH, RCC1, NCAPD2 LPAR3 1042/4885ENPP2 4381/4885LPAR1 1832/4885
US-20120115108-A1 POLYMERIZABLE PHOSPHORIC ACID DERIVATIVES COMPRISING A POLYALICYLIC STRUCTURE ELEMENT CAD, PCBP1, PPIP5K2 LPAR3 3273/4885ENPP2 1012/4885LPAR1 2921/4885

“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.