⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11568653 | 0.77 | — | — | |
| SCHEMBL6396783 | 0.75 | — | — | |
| SCHEMBL3128631 | 0.72 | — | — | |
| SCHEMBL9576360 | 0.72 | — | — | |
| SCHEMBL17909909 | 0.70 | — | — | |
| SCHEMBL4445002 | 0.68 | — | — | |
| SCHEMBL25477068 | 0.67 | — | — | |
| SCHEMBL2790087 | 0.67 | — | — | |
| SCHEMBL3857657 | 0.66 | ITGB3 (0.33) | — | |
| SCHEMBL380024 | 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 99 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090298747-A1 | Methods and Compositions For Treatment of Nitric Oxide-Induced Clinical Conditions | BIO HOLDING, INC. (US) | 2009-12-03 | — | — | US | claimed |
| WO-2014063189-A1 | METHODS AND PRODUCTS FOR PREVENTING AND/OR TREATING A STRESS INDUCED CARDIOMYOPATHY | ADELAIDE RESEARCH & INNOVATION PTY LTD (AU) | 2014-05-01 | — | — | WO | disclosed |
| US-20120309717-A1 | COMPOUNDS, METHODS AND PHARMACEUTICAL COMPOSITIONS FOR INHIBITING PARP | EISAI INC. (US) | 2012-12-06 | — | — | US | disclosed |
| EP-1633362-B1 | COMPOUNDS, METHODS AND PHARMACEUTICAL COMPOSITIONS FOR INHIBITING PARP | EISAI INC (US) | 2012-09-26 | — | — | EP | disclosed |
| US-8129382-B2 | Compounds, methods and pharmaceutical compositions for inhibiting PARP | EISAI INC. (US) | 2012-03-06 | — | — | US | disclosed |
| US-7915280-B2 | Compounds and their uses | EISAI INC. (US) | 2011-03-29 | — | — | US | disclosed |
| US-20100256095-A1 | COMPOUNDS, METHODS AND PHARMACEUTICAL COMPOSITIONS FOR INHIBITING PARP | EISAI INC. (US) | 2010-10-07 | — | — | US | disclosed |
| EP-1339402-B1 | AZAPHENANTHRIDONE DERIVATIVES AND THEIR USE AS PARP INHIBITORS | EISAI INC (US) | 2010-08-25 | — | — | EP | disclosed |
| US-7750008-B2 | Compounds, methods and pharmaceutical compositions for inhibiting PARP | EISAI INC. (US) | 2010-07-06 | — | — | US | disclosed |
| US-RE41150-E1 | Poly(adenosine 5'-diphospho-ribose) polymerase (PARP) inhibitors; compounds based on thieno(4,3,2-ef)(2)benzazepin-6-one | EISAI CORPORATION OF NORTH AMERICA (US) | 2010-02-23 | — | — | US | disclosed |
| WO-1999011649-A2 | PARP INHIBITORS, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, AND METHODS OF USING SAME | GUILFORD PHARMACEUTICALS INC. (US) | 1999-03-11 | — | — | WO | disclosed |
| WO-1999011645-A1 | POLY(ADP-RIBOSE) POLYMERASE ('PARP') INHIBITORS, METHODS AND PHARMACEUTICAL COMPOSITIONS FOR TREATING NEURAL OR CARDIOVASCULAR TISSUE DAMAGE | GUILFORD PHARMACEUTICALS INC. (US) | 1999-03-11 | — | — | WO | disclosed |
| WO-1999011623-A1 | THIOALKYL COMPOUNDS, METHODS, AND COMPOSITIONS FOR INHIBITING PARP ACTIVITY | GUILFORD PHARMACEUTICALS INC. (US) | 1999-03-11 | — | — | WO | disclosed |
| WO-1999011624-A1 | OXO-SUBSTITUTED COMPOUNDS, PROCESS OF MAKING, AND COMPOSITIONS AND METHODS FOR INHIBITING PARP ACTIVITY | GUILFORD PHARMACEUTICALS INC. (US) | 1999-03-11 | — | — | WO | disclosed |
| CN-1181700-A | Mercapto and seleno derivatives as nitric oxide synthase inhibitors | CHILDRENS HOSP MEDICAL CENTER (US) | 1998-05-13 | — | — | CN | 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 |
| WO-1997045108-A1 | GUANIDINO DERIVATIVES AS INHIBITORS OF THE CYTOTOXIC EFFECT OF PEROXYNITRITE | CHILDREN'S HOSPITAL MEDICAL CENTER (US) | 1997-12-04 | — | — | WO | disclosed |
| US-5674907-A | Mercapto derivatives as inhibitors of nitric oxide synthase | CHILDREN'S HOSPITAL MEDICAL CENTER (US) | 1997-10-07 | — | — | US | disclosed |
| WO-1997032575-A1 | MERCAPTO DERIVATIVES AS INHIBITORS OF CYCLOOXYGENASES | CHILDREN'S HOSPITAL MEDICAL CENTER (US) | 1997-09-12 | — | — | WO | 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 |