SCHEMBL10060090

SCHEMBL10060090

C=C(C)C(=O)OCCNC(=O)N(CC)C(=O)CCC(=O)OCCOC(=O)C(=C)C

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.44
TSHR P16473 3/20 0.37
MAPT P10636 1/20 0.31
BLM P54132 1/20 0.31
DGKA P23743 1/20 0.30
POLB P06746 1/20 0.30
APEX1 P27695 1/20 0.30
HTT P42858 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL10060085 0.89 THRB (0.45) THRBTSHRPOLBAPEX1HTT
SCHEMBL10106359 0.82 THRB (0.46) THRBTSHRPOLBAPEX1HTT
SCHEMBL10106382 0.81 THRB (0.44) THRBTSHRPOLBAPEX1HTT
SCHEMBL10060095 0.80 THRB (0.46) THRBTSHRPOLBAPEX1HTT
SCHEMBL17485796 0.76 THRB (0.47) THRBTSHRPOLBAPEX1HTT
SCHEMBL19027430 0.76 THRB (0.45) THRBTSHRMAPTBLMDGKA
SCHEMBL16744077 0.75 THRB (0.61) THRBTSHRMAPTBLMDGKA
SCHEMBL124287 0.75 THRB (0.61) THRBTSHRMAPTBLMDGKA
SCHEMBL10060076 0.75 THRB (0.44) THRBTSHR
SCHEMBL10060093 0.74 THRB (0.42) THRBTSHRPOLBAPEX1HTT

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
EP-2436365-B1 Composite material comprising a monomer with a polyalicyclic structure element VOCO GMBH (DE) 2017-03-08 EP disclosed
EP-2436366-B1 Composite material comprising a monomer with a polyalicyclic structure as sealing material VOCO GMBH (DE) 2015-07-29 EP disclosed
US-9079828-B2 Polymerizable compounds comprising a polyalicylic structure element VOCO GMBH (DE) 2015-07-14 US disclosed
US-9079828-B2 Polymerizable compounds comprising a polyalicylic structure element VOCO GMBH (DE) 2015-07-14 US disclosed
US-9023916-B2 Composite material comprising a monomer with a polyalicyclic structure element VOCO GMBH (DE) 2015-05-05 US disclosed
US-9023916-B2 Composite material comprising a monomer with a polyalicyclic structure element VOCO GMBH (DE) 2015-05-05 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-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-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-20120082637-A1 Lacquer Composition Comprising a Monomer with a Polyalicyclic Structure Element VOCO GMBH (DE) 2012-04-05 US disclosed
US-20120082637-A1 Lacquer Composition Comprising a Monomer with a Polyalicyclic Structure Element 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
US-20120083550-A1 Composite Material Comprising a Monomer with a Polyalicyclic Structure Element as a Sealing Material VOCO GMBH (DE) 2012-04-05 US disclosed
US-20120083550-A1 Composite Material Comprising a Monomer with a Polyalicyclic Structure Element as a Sealing Material VOCO GMBH (DE) 2012-04-05 US disclosed
US-20120082958-A1 Composite Material Comprising a Monomer with a Polyalicyclic Structure Element VOCO GMBH (DE) 2012-04-05 US disclosed
US-20120082958-A1 Composite Material Comprising a Monomer with a Polyalicyclic Structure Element VOCO GMBH (DE) 2012-04-05 US 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-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
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 (4 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-20120082958-A1 Composite Material Comprising a Monomer with a Polyalicyclic Structure Element INTS9, PARG, SMCHD1 THRB 4587/4885TSHR 4846/4885MAPT 1863/4885
US-20120082959-A1 Polymerizable Compounds Comprising a Polyalicylic Structure Element PCBP1, PUF60, PARG THRB 4037/4885TSHR 4695/4885MAPT 1058/4885
US-20120082637-A1 Lacquer Composition Comprising a Monomer with a Polyalicyclic Structure Element PELP1, ERCC1, GLRA1 THRB 2532/4885TSHR 1595/4885MAPT 1825/4885
US-20120083550-A1 Composite Material Comprising a Monomer with a Polyalicyclic Structure Element as a Sealing Material ERCC1, PARG, EPN1 THRB 4507/4885TSHR 4875/4885MAPT 2170/4885

“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.