SCHEMBL5514535

SCHEMBL5514535

C=CCC(C)(C=O)OC(=O)C=C

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.34
ALDH1A1 P00352 4/20 0.33
TP53 P04637 3/20 0.33
HIF1A Q16665 3/20 0.33
CYP3A4 P08684 2/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.32
THRB P10828 1/20 0.32

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
SCHEMBL28694555 0.81 HTT (0.33)
SCHEMBL5523682 0.78 ALDH1A1 (0.34) TSHRALDH1A1THRB
SCHEMBL3666505 0.78 TSHR (0.38) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL27434696 0.76 TSHR (0.36) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL4566184 0.74 TSHR (0.38) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL11500776 0.74 TSHR (0.35) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL28392327 0.73 THRB (0.39) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL29134499 0.73 ALDH1A1 (0.39) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL16155390 0.73
SCHEMBL11493310 0.71 THRB (0.40) TSHRALDH1A1TP53HIF1ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4191838-A Acryloxy-alkylpropanals and methacryloxy-alkylpropanals BASF AKTIENGESELLSCHAFT (DE) 1980-03-04 US claimed
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
EP-3781636-A1 ADDITIVE COMPOSITION FOR AQUEOUS DISPERSIONS OF HYDROPHOBIC POLYMERS BASF SE (DE) 2021-02-24 EP disclosed
EP-3781622-A1 ADHESIVE COMPOSITION HAVING A GEL CONTENT BASED ON CROSS-LINKING VIA KETO GROUPS OR ALDEHYDE GROUPS BASF SE (DE) 2021-02-24 EP disclosed
EP-3755753-A2 METHOD FOR PRODUCING ARTICLES COATED WITH ADHESIVE BASF SE (DE) 2020-12-30 EP disclosed
WO-2019201696-A1 ADHESIVE COMPOSITION HAVING A GEL CONTENT BASED ON CROSS-LINKING VIA KETO GROUPS OR ALDEHYDE GROUPS BASF SE (DE) 2019-10-24 WO disclosed
WO-2019201695-A1 ADDITIVE COMPOSITION FOR AQUEOUS DISPERSIONS OF HYDROPHOBIC POLYMERS BASF SE (DE) 2019-10-24 WO disclosed
WO-2019162206-A2 METHOD FOR PRODUCING ARTICLES COATED WITH ADHESIVE BASF SE (DE) 2019-08-29 WO disclosed
US-7175892-B2 Emulsion and coating liquid and recording medium using the same ASAHI KASEI KABUSHIKI KAISHA (JP) 2007-02-13 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
US-4267091-A COMPRIZING ACRYLIC COPOLYMER EMULSIONS, DIHYDRAZINE COMPOUNDS AND WATER SOLUBLE METAL SALTS BASF AKTIENGESELLSCHAFT (DE) 1981-05-12 US disclosed
US-4191838-A Acryloxy-alkylpropanals and methacryloxy-alkylpropanals BASF AKTIENGESELLSCHAFT (DE) 1980-03-04 US disclosed
US-4191838-A Acryloxy-alkylpropanals and methacryloxy-alkylpropanals BASF AKTIENGESELLSCHAFT (DE) 1980-03-04 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-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 276/4885TP53 2126/4885

“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.