⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27588516 | 0.79 | — | — | |
| SCHEMBL214348 | 0.36 | — | — | |
| Hydrochloric Acid SCHEMBL6244319 | 0.31 | — | — | |
| Hydrochloric Acid SCHEMBL945694 | 0.31 | — | — | |
| Hydrochloric Acid SCHEMBL1449238 | 0.31 | — | — | |
| Hydrochloric Acid SCHEMBL72335 | 0.31 | — | — | |
| SCHEMBL12992748 | 0.29 | — | — | |
| SCHEMBL2779948 | 0.27 | — | — | |
| SCHEMBL31437084 | 0.27 | TSHR (0.50) | — | |
| Water SCHEMBL6174686 | 0.25 | — | — |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1718201-B1 | SUBSTITUTED PORPHYRINS | UNIV DUKE (US) | 2016-09-14 | — | — | EP | disclosed |
| US-20150344509-A1 | SUBSTITUTED PORPHYRINS | UNIV DUKE (US) | 2015-12-03 | — | — | US | disclosed |
| US-9096628-B2 | Substituted porphyrins | DUKE UNIVERSITY (US) | 2015-08-04 | — | — | US | disclosed |
| US-20140080797-A1 | SUBSTITUTED PORPHYRINS | DUKE UNIVERSITY (US) | 2014-03-20 | — | — | US | disclosed |
| US-8618089-B2 | Substituted porphyrins | DUKE UNIVERSITY (US) | 2013-12-31 | — | — | US | disclosed |
| US-20120264725-A1 | SUBSTITUTED PORPHYRINS | BATINIC-HABERLE INES (US) | 2012-10-18 | — | — | US | disclosed |
| US-8183364-B2 | Substituted porphyrins | DUKE UNIVERSITY (US) | 2012-05-22 | — | — | US | disclosed |
| US-20100305083-A1 | SUBSTITUTED PORPHYRINS | BATINIC-HABERLE INES | 2010-12-02 | — | — | US | disclosed |
| US-7807825-B2 | Substituted porphyrins | DUKE UNIVERSITY (US) | 2010-10-05 | — | — | US | disclosed |
| US-20080021007-A1 | Substituted Porphyrins | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2008-01-24 | — | — | US | disclosed |
| US-7094904-B2 | Process for preparing monohydrate and crystal modifications of fluconazole | RICHTER GEDEON VEGYESZETI GYAR RT. (HU) | 2006-08-22 | — | — | US | disclosed |
| EP-1373227-B1 | PROCESS FOR PREPARING FLUCONAZOLE AND ITS CRYSTAL MODIFICATIONS | RICHTER GEDEON VEGYESZET (HU) | 2005-11-09 | — | — | EP | disclosed |
| US-20040106804-A1 | Process for preparing monohydrate and crystal modifications of fluconazole | RICHTER GEDEON VEGYESZETI GYAR RT. | 2004-06-03 | — | — | US | disclosed |
| EP-1373227-A1 | PROCESS FOR PREPARING FLUCONAZOLE AND ITS CRYSTAL MODIFICATIONS | RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) | 2004-01-02 | — | — | EP | disclosed |
| WO-2002076955-A1 | PROCESS FOR PREPARING FLUCONAZOLE AND ITS CRYSTAL MODIFICATIONS | RICHTER GEDEON VEGYESZÉTI GYÁR RT. (HU) | 2002-10-03 | — | — | WO | disclosed |
| EP-0122452-A1 | Triazolyl- and imidazolyl-substituted fluoroalkane derivatives, process for their preparation and pharmaceutical compositions containing them | SCHERING CORPORATION (US) | 1984-10-24 | — | — | EP | disclosed |