SCHEMBL2944780

SCHEMBL2944780

O=CN1CC(=O)OC(=O)C1

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.38

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
SCHEMBL21617961 0.73
SCHEMBL10548811 0.69
SCHEMBL3390306 0.67
SCHEMBL1101969 0.65 ALDH1A1 (0.33) TSHR
SCHEMBL23850763 0.65
SCHEMBL126833 0.63 TSHR (0.40) TSHR
SCHEMBL13800448 0.63 TSHR (0.40) TSHR
SCHEMBL25131198 0.61 GABRP (0.31)
SCHEMBL28678933 0.59 TSHR (0.36) TSHR
SCHEMBL4332885 0.59

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1603597-B1 OXYCODONE CONJUGATES WITH LOWER ABUSE POTENTIAL AND EXTENDED DURATION OF ACTION CONTROLLED CHEMICALS INC (US) 2010-01-06 EP disclosed
US-20070203165-A1 COMPOUNDS AND METHODS FOR LOWERING THE ABUSE POTENTIAL AND EXTENDING THE DURATION OF ACTION OF A DRUG CONTROLLED CHEMICALS, INC. (US) 2007-08-30 US disclosed
US-7230005-B2 Compounds and methods for lowering the abuse potential and extending the duration of action of a drug CONTROLLED CHEMICALS, INC. (US) 2007-06-12 US disclosed
EP-1782834-A2 OXYCODONE CONJUGATES WITH LOWER ABUSE POTENTIAL AND EXTENDED DURATION OF ACTION Controlled Chemicals, Inc. (US) 2007-05-09 EP disclosed
EP-1603597-A2 OXYCODONE CONJUGATES WITH LOWER ABUSE POTENTIAL AND EXTENDED DURATION OF ACTION Controlled Chemicals, Inc. (US) 2005-12-14 EP disclosed
US-20040204434-A1 Compounds and methods for lowering the abuse potential and extending the duration of action of a drug CONTROLLED CHEMICALS INC. 2004-10-14 US disclosed
WO-2004082620-A2 OXYCODONE CONJUGATES WITH LOWER THE ABUSE POTENTIAL AND EXTENDED DURATION OF ACTION CONTROLLED CHEMICALS, INC. (US) 2004-09-30 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 (2 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-20040204434-A1 Compounds and methods for lowering the abuse potential and extending the duration of action of a drug CRH, OPRK1, SI TSHR 4533/4885
US-20070203165-A1 COMPOUNDS AND METHODS FOR LOWERING THE ABUSE POTENTIAL AND EXTENDING THE DURATION OF ACTION OF A DRUG CRH, OPRK1, SI TSHR 4533/4885

“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.