SCHEMBL6416183

SCHEMBL6416183

C=CCC(N)(N)C(=C)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.36
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL13727785 0.82 HTT (0.36) HTTALDH1A1TSHRALOX15HSD17B10
SCHEMBL3807763 0.80 HTT (0.35) HTTALDH1A1TSHRALOX15HSD17B10
SCHEMBL28778911 0.78
SCHEMBL363110 0.76 ALDH1A1 (0.36) HTTALDH1A1TSHRALOX15HSD17B10
SCHEMBL10604493 0.74 ALDH1A1 (0.35) HTTALDH1A1TSHRALOX15HSD17B10
SCHEMBL5617495 0.74 ALDH1A1 (0.35) HTTALDH1A1TSHRALOX15HSD17B10
Oxalic Acid SCHEMBL11437762 0.73 HTT (0.39) HTTALDH1A1TSHRALOX15HSD17B10
Acetic Acid SCHEMBL8553823 0.73 ALDH1A1 (0.38) HTTALDH1A1TSHR
SCHEMBL17975859 0.73 ALDH1A1 (0.38) HTTALDH1A1TSHRALOX15HSD17B10
SCHEMBL11044584 0.73 ALDH1A1 (0.34) HTTALDH1A1TSHRALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6855268-B1 Composition useful for conditioning sludge derived from the treatment of an aqueous medium and uses thereof RHODIA CHIMIE (FR) 2005-02-15 US claimed
EP-1404619-A2 PROCEDE DE CONDITIONEMENT OU DE DESHYDRATATION DE BOUES ISSUES DE L'INDUSTRIE PAPETIERE OU AGRO-ALIMENTAIRE RHODIA CHIMIE (FR) 2004-04-07 EP claimed
EP-1373149-A1 COMPOSITION THAT CAN BE USED FOR CONDITIONING SLUDGE RHODIA CHIMIE (FR) 2004-01-02 EP claimed
WO-2002076894-A1 COMPOSITION THAT CAN BE USED FOR CONDITIONING SLUDGE RHODIA CHIMIE (FR) 2002-10-03 WO claimed
WO-2002076891-A2 METHOD FOR CONDITIONING OR DEWATERING SLUDGE DERIVED FROM THE PAPER INDUSTRY OR AGRI-INDUSTRY RHODIA CHIMIE (FR) 2002-10-03 WO claimed
EP-1216207-A1 COMPOSITION USEFUL FOR CONDITIONING SLUDGE DERIVED FROM THE TREATMENT OF AN AQUEOUS MEDIUM AND USES THEREOF Rhodia Chimie (FR) 2002-06-26 EP claimed
WO-2001021532-A1 COMPOSITION USEFUL FOR CONDITIONING SLUDGE DERIVED FROM THE TREATMENT OF AN AQUEOUS MEDIUM AND USES THEREOF RHODIA CHIMIE (FR) 2001-03-29 WO claimed
US-20130123104-A1 Adjuvant Compositions, Agricultural Pesticide Compositions, and Methods for Making and Using Such Compositions RHODIA OPERATIONS (FR) 2013-05-16 US disclosed
US-6855268-B1 Composition useful for conditioning sludge derived from the treatment of an aqueous medium and uses thereof RHODIA CHIMIE (FR) 2005-02-15 US disclosed
EP-1404619-A2 PROCEDE DE CONDITIONEMENT OU DE DESHYDRATATION DE BOUES ISSUES DE L'INDUSTRIE PAPETIERE OU AGRO-ALIMENTAIRE RHODIA CHIMIE (FR) 2004-04-07 EP disclosed
EP-1373149-A1 COMPOSITION THAT CAN BE USED FOR CONDITIONING SLUDGE RHODIA CHIMIE (FR) 2004-01-02 EP disclosed
WO-2002076894-A1 COMPOSITION THAT CAN BE USED FOR CONDITIONING SLUDGE RHODIA CHIMIE (FR) 2002-10-03 WO disclosed
WO-2002076891-A2 METHOD FOR CONDITIONING OR DEWATERING SLUDGE DERIVED FROM THE PAPER INDUSTRY OR AGRI-INDUSTRY RHODIA CHIMIE (FR) 2002-10-03 WO disclosed
EP-1216207-A1 COMPOSITION USEFUL FOR CONDITIONING SLUDGE DERIVED FROM THE TREATMENT OF AN AQUEOUS MEDIUM AND USES THEREOF Rhodia Chimie (FR) 2002-06-26 EP disclosed
WO-2001021532-A1 COMPOSITION USEFUL FOR CONDITIONING SLUDGE DERIVED FROM THE TREATMENT OF AN AQUEOUS MEDIUM AND USES THEREOF RHODIA CHIMIE (FR) 2001-03-29 WO 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-20130123104-A1 Adjuvant Compositions, Agricultural Pesticide Compositions, and Methods for Making and Using Such Compositions SGMS1, CHRM3, CHRM2 HTT 2203/4885ALDH1A1 3009/4885TSHR 542/4885

“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.