SCHEMBL2043003

SCHEMBL2043003

C=C(C)C(=O)OCCN(C)CCC(C=O)CCCC(C)C=O

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.35
THRB P10828 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
SCHEMBL2042372 0.88 TSHR (0.35) TSHRTHRB
SCHEMBL2046668 0.85 TSHR (0.35) TSHRTHRB
SCHEMBL2047035 0.84 TSHR (0.38) TSHRTHRB
SCHEMBL2043006 0.80 TSHR (0.37) TSHRTHRB
SCHEMBL2041836 0.80 TSHR (0.37) TSHRTHRB
SCHEMBL2041837 0.80 TSHR (0.37) TSHRTHRB
SCHEMBL2042374 0.78 TSHR (0.37) TSHRTHRB
SCHEMBL712423 0.75 THRB (0.53) TSHRTHRB
SCHEMBL2044226 0.75 TSHR (0.38) TSHRTHRB
SCHEMBL2048514 0.75 USP2 (0.36) TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110144267-A1 FUNCTIONALIZED (METH)ACRYLATE MONOMER, POLYMER, COATING AGENT, AND PRODUCTION AND CROSS-LINKING METHOD EVONIK ROEHM GMBH (DE) 2011-06-16 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-20110144267-A1 FUNCTIONALIZED (METH)ACRYLATE MONOMER, POLYMER, COATING AGENT, AND PRODUCTION AND CROSS-LINKING METHOD DNMT1, TET1, MGMT TSHR 2023/4885THRB 2750/4885

“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.