SCHEMBL5523685

SCHEMBL5523685

C=CC(OC(=O)C(=C)C)C(=O)CC

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.37
ALDH1A1 P00352 3/20 0.35
THRB P10828 1/20 0.35

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
SCHEMBL169726 0.79 ALDH1A1 (0.39) TSHRALDH1A1THRB
SCHEMBL9514502 0.77 ALDH1A1 (0.38) TSHRALDH1A1
SCHEMBL16767715 0.77 ALDH1A1 (0.38) TSHRALDH1A1
SCHEMBL28104274 0.73 TSHR (0.39) TSHRALDH1A1THRB
SCHEMBL9048760 0.72 MEN1 (0.35) TSHRALDH1A1
SCHEMBL27385530 0.71 ALDH1A1 (0.44) TSHRALDH1A1THRB
SCHEMBL809303 0.70 ALDH1A1 (0.40) TSHRALDH1A1THRB
Bicarbonate SCHEMBL27518089 0.70 TSHR (0.37) TSHRALDH1A1THRB
SCHEMBL18427851 0.70 THRB (0.39) TSHRALDH1A1THRB
SCHEMBL3846902 0.70 ALDH1A1 (0.32) TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240002581-A1 SEMICARBAZIDE COMPOSITION AND WATER-BASED COATING COMPOSITION ASAHI KASEI KABUSHIKI KAISHA (JP) 2024-01-04 US disclosed
EP-4245751-A1 SEMICARBAZIDE COMPOSITION AND AQUEOUS COATING COMPOSITION Asahi Kasei Kabushiki Kaisha (JP) 2023-09-20 EP disclosed
US-20220010163-A1 SEMICARBAZIDE COMPOSITION, WATER-BASED COATING COMPOSITION, COATING FILM, ARTICLE, AND METHOD FOR PRODUCING SEMICARBAZIDE COMPOSITION ASAHI KASEI KABUSHIKI KAISHA (JP) 2022-01-13 US disclosed
EP-3889223-A1 SEMICARBAZIDE COMPOSITION, WATER-BASED COATING COMPOSITION, COATING FILM, ARTICLE, AND METHOD FOR PRODUCING SEMICARBAZIDE COMPOSITION Asahi Kasei Kabushiki Kaisha (JP) 2021-10-06 EP disclosed
US-7175892-B2 Emulsion and coating liquid and recording medium using the same ASAHI KASEI KABUSHIKI KAISHA (JP) 2007-02-13 US disclosed
EP-1626060-A1 Monomeric composition, copolymers obtainable therefrom and aqueous dispersions containing them Celanese Emulsions Iberica, S.L. (ES) 2006-02-15 EP disclosed
US-20060020079-A1 Monomeric composition, copolymers obtainable therefrom and aqueous dispersions containing them CELANESE EMULSIONS IBERICA, S.L. 2006-01-26 US disclosed
US-20040115370-A1 Emulsion and coating liquid and recording medium using the same ASAHI KASEI KABUSHIKI KAISHA (JP) 2004-06-17 US disclosed
EP-1380438-A1 EMULSION AND COATING LIQUID AND RECORDING MEDIUM USING THE SAME Asahi Kasei Kabushiki Kaisha (JP) 2004-01-14 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 (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-20240002581-A1 SEMICARBAZIDE COMPOSITION AND WATER-BASED COATING COMPOSITION H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HDAC1, H1-0 TSHR 4198/4885ALDH1A1 276/4885THRB 2866/4885

“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.