SCHEMBL3485719

SCHEMBL3485719

NOCC(=O)N(CCC(=O)O)CCC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.48
▸ CTH P32929 1/20 0.48
▸ CBS P35520 1/20 0.48
▸ THPO P40225 1/20 0.48
▸ THRB P10828 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.37
▸ ALDH2 P05091 1/20 0.37
▸ PHF8 Q9UPP1 4/20 0.33
▸ KDM2A Q9Y2K7 4/20 0.33
▸ LMNA P02545 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ KDM5C P41229 1/20 0.33
▸ ALKBH5 Q6P6C2 1/20 0.33
▸ SUCNR1 Q9BXA5 1/20 0.33
▸ EGLN1 Q9GZT9 1/20 0.33
▸ GABRP O00591 3/20 0.32
▸ GABRD O14764 3/20 0.32
▸ GABRA1 P14867 3/20 0.32
▸ GABRB1 P18505 3/20 0.32
▸ GABRG2 P18507 3/20 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
SCHEMBL16351009 0.75 ALDH1A1 (0.50) ALDH1A1ALDH2PHF8KDM2ALMNA
SCHEMBL7654294 0.70 ALDH1A1 (0.41) TSHRALDH1A1ALDH2PHF8KDM2A
SCHEMBL9639525 0.70 LMNA (0.48) TSHRCTHCBSTHPOTHRB
SCHEMBL22398276 0.68 — —
Carboxymethoxylamine SCHEMBL98144 0.67 — —
Carboxymethoxylamine SCHEMBL17417922 0.67 TSHR (1.00) TSHRCTHCBSTHPOTHRB
SCHEMBL14009949 0.67 LMNA (0.38) TSHRTHRBALDH1A1ALDH2PHF8
SCHEMBL14205321 0.67 FFAR3 (0.52) TSHRALDH1A1ALDH2PHF8KDM5C
Carboxymethoxylamine SCHEMBL23752052 0.65 — —
Carboxymethoxylamine SCHEMBL1255081 0.65 — —

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-20140274903-A1 USE OF GALACTOSE OXIDASE FOR SELECTIVE CHEMICAL CONJUGATION OF PROTRACTOR MOLECULES TO PROTEINS OF THERAPEUTIC INTEREST NOVO NORDISK HEALTHCARE AG (CH) 2014-09-18 — — US disclosed
US-20140274903-A1 USE OF GALACTOSE OXIDASE FOR SELECTIVE CHEMICAL CONJUGATION OF PROTRACTOR MOLECULES TO PROTEINS OF THERAPEUTIC INTEREST NOVO NORDISK HEALTHCARE AG (CH) 2014-09-18 — — US disclosed
US-20140274903-A1 USE OF GALACTOSE OXIDASE FOR SELECTIVE CHEMICAL CONJUGATION OF PROTRACTOR MOLECULES TO PROTEINS OF THERAPEUTIC INTEREST NOVO NORDISK HEALTHCARE AG (CH) 2014-09-18 — — US disclosed
US-20100028939-A1 Use of Galactose Oxidase for Selective Chemical Conjugation of Protractor Molecules to Proteins of Therapeutic Interest NOVO NORDISK HEALTHCARE A/G (CH) 2010-02-04 — — US disclosed
US-20100028939-A1 Use of Galactose Oxidase for Selective Chemical Conjugation of Protractor Molecules to Proteins of Therapeutic Interest NOVO NORDISK HEALTHCARE A/G (CH) 2010-02-04 — — US disclosed
US-20100028939-A1 Use of Galactose Oxidase for Selective Chemical Conjugation of Protractor Molecules to Proteins of Therapeutic Interest NOVO NORDISK HEALTHCARE A/G (CH) 2010-02-04 — — US disclosed
US-20060198819-A1 Use of galactose oxidase for selective chemical conjugation of protractor molecules to proteins of therapeutic interest NOVO NORDISK HEALTHCARE A/G (CH) 2006-09-07 — — US disclosed
EP-1653996-A2 USE OF GALACTOSE OXIDASE FOR SELECTIVE CHEMICAL CONJUGATION OF PROTRACTOR MOLECULES TO PROTEINS OF THERAPEUTIC INTEREST Novo Nordisk Health Care AG (CH) 2006-05-10 — — EP disclosed
WO-2005014035-A2 USE OF GALACTOSE OXIDASE FOR SELECTIVE CHEMICAL CONJUGATION OF PROTRACTOR MOLECULES TO PROTEINS OF THERAPEUTIC INTEREST NOVO NORDISK HEALTH CARE AG (CH) 2005-02-17 — — 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 (3 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-20060198819-A1 Use of galactose oxidase for selective chemical conjugation of protractor molecules to proteins of therapeutic interest GALE, GALNT2, GALNT1 TSHR 1226/4885CTH 1867/4885CBS 3337/4885
US-20140274903-A1 USE OF GALACTOSE OXIDASE FOR SELECTIVE CHEMICAL CONJUGATION OF PROTRACTOR MOLECULES TO PROTEINS OF THERAPEUTIC INTEREST GALE, GALNT2, GALNT1 TSHR 1226/4885CTH 1867/4885CBS 3337/4885
US-20100028939-A1 Use of Galactose Oxidase for Selective Chemical Conjugation of Protractor Molecules to Proteins of Therapeutic Interest GALE, GALNT2, GALNT1 TSHR 1226/4885CTH 1867/4885CBS 3337/4885

“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.

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