⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2289375 | 0.92 | — | — | |
| SCHEMBL6843334 | 0.90 | CYP2C19 (0.43) | — | |
| SCHEMBL6843354 | 0.90 | CYP2C19 (0.43) | — | |
| SCHEMBL25281666 | 0.90 | CYP2C19 (0.43) | — | |
| SCHEMBL12506492 | 0.90 | CYP2C19 (0.43) | — | |
| SCHEMBL1879803 | 0.83 | — | — | |
| SCHEMBL7908937 | 0.83 | CYP2C19 (0.55) | — | |
| SCHEMBL27822244 | 0.83 | CYP2C19 (0.55) | — | |
| SCHEMBL14478080 | 0.80 | CYP2C19 (0.52) | — | |
| SCHEMBL6871500 | 0.80 | CYP2C19 (0.52) | — |
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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2192109-B1 | BICYCLIC -AMINO ACID DERIVATIVE | DAIICHI SANKYO CO LTD (JP) | 2013-09-04 | — | — | EP | disclosed |
| US-7947738-B2 | Bicyclic γ-amino acid derivative | DAIICHI SANKYO COMPANY, LTD. (JP) | 2011-05-24 | — | — | US | disclosed |
| US-20100249229-A1 | BICYCLIC gamma-AMINO ACID DERIVATIVE | DAIICHI SANKYO COMPANY, LTD. (JP) | 2010-09-30 | — | — | US | disclosed |
| EP-2192109-A1 | BICYCLIC -AMINO ACID DERIVATIVE | Daiichi Sankyo Company, Limited (JP) | 2010-06-02 | — | — | EP | disclosed |
| EP-1829876-A1 | NITROGENEOUS TRICYCLIC COMPOUND | Asahi Kasei Pharma Corporation (JP) | 2007-09-05 | — | — | EP | disclosed |
| US-20060247266-A1 | Nitrogen-containing tricyclic compounds | ASAHI KASEI PHARMA CORPORATION (JP) | 2006-11-02 | — | — | US | disclosed |
| US-6900282-B2 | Derivatized polyurethane compositions which exhibit enhanced stability in biological systems and methods of making the same | THE CHILDREN'S HOSPITAL OF PHILADELPHIA (US) | 2005-05-31 | — | — | US | disclosed |
| US-6890998-B2 | Thiol activation of polyurethanes and methods of making the same | THE CHILDREN'S HOSPITAL OF PHILADELPHIA (US) | 2005-05-10 | — | — | US | disclosed |
| US-20040102598-A1 | Novel thiol activation of polyurethanes and methods of making the same | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2004-05-27 | — | — | US | disclosed |
| US-20040092698-A1 | Derivatized polyurethane compositions which exhibit enhanced stability in biological systems and methods of making the same | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2004-05-13 | — | — | US | disclosed |
| WO-2004029581-A2 | METHOD OF DETERMINING SURFACE BINDING CAPACITY | THE CHILDREN'S HOSPITAL OF PHILADELPHIA (US) | 2004-04-08 | — | — | WO | disclosed |
| WO-2004029124-A1 | NOVEL THIOL ACTIVATION OF POLYURETHANES AND METHODS OF MAKING THE SAME | THE CHILDREN'S HOSPITAL OF PHILADELPHIA (US) | 2004-04-08 | — | — | WO | disclosed |
| US-20040063158-A1 | Method of determining surface binding capacity | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2004-04-01 | — | — | US | disclosed |
| US-5990328-A | FORMING 4-NITRO-3-KETOSTEROIDS WHICH BY NITRATION OF THE CORRESPONDING 3,5-DIENOLATE, REDUCTION OF 4-NITRO-3-KETOSTEROID FORMS 4-AMINO-3-KETOSTEROID | MERRELL PHARMACEUTICALS INC. (US) | 1999-11-23 | — | — | US | disclosed |
| US-5965550-A | INHIBITING STEROID C17-20 LYASE BY ADMINISTERING A 4-NITRO STEROID INHIBITORY COMPOUND OF GIVEN FORMULA, SUCH AS 17B-CYCLOPROPYLOXY-4-NITROANDROST-4-EN-3-ONE; INHIBITS FORMATION OF BOTH ANDROGENIC AND ESTROGENIC STEROIDS | MERRELL PHARMACEUTICALS INC. (US) | 1999-10-12 | — | — | US | disclosed |
| US-5869475-A | Certain 3-ketosteroids used to inhibit steroid 5α-reductase | MERRELL PHARMACEUTICALS, INC. (US) | 1999-02-09 | — | — | US | disclosed |
| EP-0758340-B1 | PROCESS FOR THE PREPARATION OF 4-AMINO-DELTA 4-3-KETOSTEROIDS VIA 4-NITRO-DELTA 4-3-KETOSTEROIDS | MERRELL PHARMA INC (US) | 1999-01-07 | — | — | EP | disclosed |
| US-5750744-A | ENZYME INHIBITORS | MERRELL PHARMACEUTICALS INC. (US) | 1998-05-12 | — | — | US | disclosed |
| EP-0758340-A1 | PROCESS FOR THE PREPARATION OF 4-AMINO-DELTA 4-3-KETOSTEROIDS VIA 4-NITRO-DELTA 4-3-KETOSTEROIDS | MERRELL PHARMACEUTICALS INC. (US) | 1997-02-19 | — | — | EP | disclosed |
| WO-1995029932-A1 | PROCESS FOR THE PREPARATION OF 4-AMINO-Δ4-3-KETOSTEROIDS VIA 4-NITRO-Δ4-3-KETOSTEROIDS | MERRELL PHARMACEUTICALS INC. (US) | 1995-11-09 | — | — | WO | disclosed |