⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11615305 | 0.58 | — | — | |
| Alloxan SCHEMBL64547 | 0.56 | MAPT (1.00) | — | |
| SCHEMBL1244845 | 0.56 | — | — | |
| Alloxan SCHEMBL20262969 | 0.54 | KDM4E (0.92) | — | |
| SCHEMBL10753161 | 0.54 | — | — | |
| SCHEMBL6988388 | 0.54 | — | — | |
| Barbituric Acid SCHEMBL1973830 | 0.52 | ALDH1A1 (0.52) | — | |
| SCHEMBL30107638 | 0.49 | — | — | |
| Hydrochloric Acid SCHEMBL546607 | 0.46 | IDH1 (0.41) | — | |
| SCHEMBL9402152 | 0.46 | IDH1 (0.41) | — |
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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20110009384-A1 | FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA | TAKEDA PHARMACEUTICAL COMPANY LIMITED | 2011-01-13 | — | — | US | claimed |
| EP-2118066-A1 | FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA | Takeda Pharmaceutical Company Limited (JP) | 2009-11-18 | — | — | EP | claimed |
| WO-2008099794-A1 | FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-08-21 | — | — | WO | claimed |
| US-20080194617-A1 | Fused ring compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-08-14 | — | — | US | claimed |
| US-20030225081-A1 | Pyridazinones and triazinones and medicinal use thereof | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2003-12-04 | — | — | US | claimed |
| EP-1319659-A1 | PYRIDAZINONES AND TRIAZINONES AND MEDICINAL USE THEREOF | Eisai Co., Ltd. (JP) | 2003-06-18 | — | — | EP | claimed |
| EP-0417555-B1 | Pentamethine dyes and derivatives | BAYER AG (DE) | 1993-11-03 | — | — | EP | claimed |
| US-5138070-A | Laser transfer printing; opticalrecording media | BAYER AKTIENGESELLSCHAFT (DE) | 1992-08-11 | — | — | US | claimed |
| EP-0417555-A1 | Pentamethine dyes and derivatives | BAYER AG (DE) | 1991-03-20 | — | — | EP | claimed |
| EP-0370198-A1 | Tetraindolyl heptamethine derivatives | BAYER AG (DE) | 1990-05-30 | — | — | EP | claimed |
| US-4255506-A | A PHOTOSENSITIVE ORGANIC PIGMENT CONTAINING ONE OR MORE VINYL GROUPS AND RING(S) OF BENZENE, NAPHTHALENE, ANTHRACENE, AND/OR DIBENZOTHIENE; COPIERS | EASTMAN KODAK COMPANY (US) | 1981-03-10 | — | — | US | claimed |
| US-4165984-A | UNSATURATED COMPOUND | EASTMAN KODAK COMPANY (US) | 1979-08-28 | — | — | US | claimed |
| US-20110009384-A1 | FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA | TAKEDA PHARMACEUTICAL COMPANY LIMITED | 2011-01-13 | — | — | US | disclosed |
| EP-2118066-A1 | FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA | Takeda Pharmaceutical Company Limited (JP) | 2009-11-18 | — | — | EP | disclosed |
| WO-2008099794-A1 | FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-08-21 | — | — | WO | disclosed |
| US-20080194617-A1 | Fused ring compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-08-14 | — | — | US | disclosed |
| EP-0370198-A1 | Tetraindolyl heptamethine derivatives | BAYER AG (DE) | 1990-05-30 | — | — | EP | disclosed |
| US-4322487-A | Composite electrically photosensitive particles for electrophoretic migration imaging process | EASTMAN KODAK COMPANY (US) | 1982-03-30 | — | — | US | disclosed |
| US-4255506-A | A PHOTOSENSITIVE ORGANIC PIGMENT CONTAINING ONE OR MORE VINYL GROUPS AND RING(S) OF BENZENE, NAPHTHALENE, ANTHRACENE, AND/OR DIBENZOTHIENE; COPIERS | EASTMAN KODAK COMPANY (US) | 1981-03-10 | — | — | US | disclosed |
| US-4165984-A | UNSATURATED COMPOUND | EASTMAN KODAK COMPANY (US) | 1979-08-28 | — | — | US | disclosed |