⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL13560704 | 0.93 | MEN1 (0.47) | — | |
| SCHEMBL13560705 | 0.91 | MEN1 (0.50) | — | |
| SCHEMBL7063396 | 0.86 | — | — | |
| SCHEMBL10311296 | 0.81 | TSHR (0.53) | — | |
| SCHEMBL17472392 | 0.78 | CYP1A2 (0.41) | — | |
| SCHEMBL21341054 | 0.78 | FNTA (0.38) | — | |
| SCHEMBL23011661 | 0.77 | — | — | |
| SCHEMBL3912185 | 0.77 | — | — | |
| SCHEMBL20204716 | 0.77 | — | — | |
| Arcaine SCHEMBL303546 | 0.77 | MEN1 (0.62) | — |
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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0814792-B1 | MERCAPTO AND SELENO DERIVATIVES AS INHIBITORS OF NITRIC OXIDE SYNTHASE | CHILDRENS HOSP MEDICAL CENTER (US) | 2003-05-28 | — | — | EP | claimed |
| US-5985917-A | ANTITUMOR AGENTS AND ENZYME INHIBITORS | CHILDREN'S HOSPITAL MEDICAL CENTER (US) | 1999-11-16 | — | — | US | claimed |
| US-5952385-A | Mercapto derivatives as inhibitors of nitric oxide synthase | CHILDREN'S HOSPITAL MEDICAL CENTER (US) | 1999-09-14 | — | — | US | claimed |
| US-5929063-A | SELECTIVELY INHIBITS THE INDUCIBLE ISOFORM TO PREVENT OVER-INHIBITION; FOR DISORDERS WHERE THE ENZYME PLAYS A ROLE, E.G SYSTEMIC HYPOTENSION, SEPTIC SHOCK AND CYTOKINE THERAPY | CHILDREN'S HOSPITAL MEDICAL CENTER (US) | 1999-07-27 | — | — | US | claimed |
| EP-0814792-A1 | MERCAPTO AND SELENO DERIVATIVES AS INHIBITORS OF NITRIC OXIDE SYNTHASE | CHILDREN'S HOSPITAL MEDICAL CENTER (US) | 1998-01-07 | — | — | EP | claimed |
| WO-1997045108-A1 | GUANIDINO DERIVATIVES AS INHIBITORS OF THE CYTOTOXIC EFFECT OF PEROXYNITRITE | CHILDREN'S HOSPITAL MEDICAL CENTER (US) | 1997-12-04 | — | — | WO | claimed |
| US-5674907-A | Mercapto derivatives as inhibitors of nitric oxide synthase | CHILDREN'S HOSPITAL MEDICAL CENTER (US) | 1997-10-07 | — | — | US | claimed |
| WO-1996030007-A1 | MERCAPTO AND SELENO DERIVATIVES AS INHIBITORS OF NITRIC OXIDE SYNTHASE | CHILDREN'S HOSPITAL MEDICAL CENTER (US) | 1996-10-03 | — | — | WO | claimed |
| US-20230285310-A1 | COMPOSITIONS FOR THE DELIVERY OF PAYLOAD MOLECULES TO AIRWAY EPITHELIUM | ARES CAPITAL CORPORATION, AS AGENT | 2023-09-14 | — | — | US | disclosed |
| US-20220412963-A1 | FLUORESCENCE TAGGING OF GLYCANS AND OTHER BIOMOLECULES THROUGH REDUCTIVE AMINATION FOR ENHANCED MS SIGNALS | WATERS TECHNOLOGIES CORPORATION | 2022-12-29 | — | — | US | disclosed |
| EP-3500252-B1 | MODIFIED PEPTIDES FOR USE IN TREATING NEURODEGENERATIVE DISORDERS | NEURO BIO LTD (GB) | 2022-11-02 | — | — | EP | disclosed |
| US-11352325-B2 | Rapid fluorescence tagging of glycans and other biomolecules with enhanced MS signals | WATERS TECHNOLOGIES CORPORATION (US) | 2022-06-07 | — | — | US | disclosed |
| US-11353461-B2 | Methods of enhancing MS detection of tagged glycans | WATERS TECHNOLOGIES CORPORATION (US) | 2022-06-07 | — | — | US | disclosed |
| WO-2021249364-A1 | NOVEL ANALOGS OF PTEROSTILBENE AMINO ACID BEARING CARBONATES FOR TREATING A NON-ALCOHOLIC FATTY LIVER DISEASE AND NONALCOHOLIC STEATOHEPATITIS | WANG, JINPING (CN) | 2021-12-16 | — | — | WO | disclosed |
| US-5985917-A | ANTITUMOR AGENTS AND ENZYME INHIBITORS | CHILDREN'S HOSPITAL MEDICAL CENTER (US) | 1999-11-16 | — | — | US | disclosed |
| US-5952385-A | Mercapto derivatives as inhibitors of nitric oxide synthase | CHILDREN'S HOSPITAL MEDICAL CENTER (US) | 1999-09-14 | — | — | US | disclosed |
| US-5929063-A | SELECTIVELY INHIBITS THE INDUCIBLE ISOFORM TO PREVENT OVER-INHIBITION; FOR DISORDERS WHERE THE ENZYME PLAYS A ROLE, E.G SYSTEMIC HYPOTENSION, SEPTIC SHOCK AND CYTOKINE THERAPY | CHILDREN'S HOSPITAL MEDICAL CENTER (US) | 1999-07-27 | — | — | US | disclosed |
| EP-0814792-A1 | MERCAPTO AND SELENO DERIVATIVES AS INHIBITORS OF NITRIC OXIDE SYNTHASE | CHILDREN'S HOSPITAL MEDICAL CENTER (US) | 1998-01-07 | — | — | EP | disclosed |
| US-5674907-A | Mercapto derivatives as inhibitors of nitric oxide synthase | CHILDREN'S HOSPITAL MEDICAL CENTER (US) | 1997-10-07 | — | — | US | disclosed |
| WO-1996030007-A1 | MERCAPTO AND SELENO DERIVATIVES AS INHIBITORS OF NITRIC OXIDE SYNTHASE | CHILDREN'S HOSPITAL MEDICAL CENTER (US) | 1996-10-03 | — | — | WO | disclosed |