SCHEMBL4457550

SCHEMBL4457550

[CH2]C([CH2])(COC(=O)C(=C)C)COC(=O)C(=C)C

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
THRB P10828 1/20 0.47
ALDH1A1 P00352 4/20 0.44
TDP1 Q9NUW8 2/20 0.34
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL17698931 0.94 TSHR (0.45) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL10350092 0.89 THRB (0.47) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL1902319 0.86 TSHR (0.50) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL9615552 0.84 TSHR (0.48) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL17698929 0.84 TSHR (0.48) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL6249922 0.84 TSHR (0.48) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL57880 0.83 TSHR (0.52) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL8965833 0.81 TSHR (0.50) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL16803285 0.81 TSHR (0.50) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL19197808 0.81 TSHR (0.50) TSHRTHRBALDH1A1TDP1POLB

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2716276-B1 Kit and method for indirect chair-side production of composite inlays VOCO GMBH (DE) 2019-04-24 EP claimed
CN-112203995-B Radiation curable compositions for coating optical fibers via alternating oligomers and coatings produced therefrom 科思创(荷兰)有限公司 2023-02-21 CN disclosed
CN-113631136-A Primer and kit of primer and dental material 凯滕巴赫股份两合公司 2021-11-09 CN disclosed
US-9833387-B2 Kit and method for indirect chairside production of composite inlays VOCO GMBH (DE) 2017-12-05 US disclosed
US-20140138864-A1 KIT AND METHOD FOR INDIRECT CHAIRSIDE PRODUCTION OF COMPOSITE INLAYS VOCO GMBH (DE) 2014-05-22 US disclosed
US-7521578-B2 Process for the preparation of (meth)acrylates of tetra- or polyhydric alcohols EVONIK ROEHM GMBH (DE) 2009-04-21 US disclosed
US-20080194861-A1 Process for the Preparation of (Meth)Acrylates of Tetra-Or Polyhydric Alcohols EVONIK ROEHM GMBH (DE) 2008-08-14 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 (1 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-20080194861-A1 Process for the Preparation of (Meth)Acrylates of Tetra-Or Polyhydric Alcohols ADH1A, ADH1C, ADH5 TSHR 103/4885THRB 36/4885ALDH1A1 18/4885

“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.