⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL278725 | 1.00 | — | — | |
| SCHEMBL2898495 | 1.00 | — | — | |
| SCHEMBL2030303 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL5356149 | 0.97 | — | — | |
| SCHEMBL28269783 | 0.97 | — | — | |
| SCHEMBL5378438 | 0.97 | — | — | |
| SCHEMBL2033981 | 0.97 | — | — | |
| SCHEMBL5370979 | 0.97 | — | — | |
| SCHEMBL6054231 | 0.80 | ALDH1A1 (0.56) | — | |
| SCHEMBL2911089 | 0.79 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100063104-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND PHARMACEUTICAL APPLICATION THEREOF | ONO PHARMACEUTICAL CO., LTD., (JP) | 2010-03-11 | — | — | US | disclosed |
| EP-1932840-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND PHARMACEUTICAL APPLICATION THEREOF | ONO PHARMACEUTICAL CO., LTD. (JP) | 2008-06-18 | — | — | EP | disclosed |
| WO-2007057909-A1 | ANDROGEN-RECEPTOR (AR) LIGANDS FOR USE IN THE TREATMENT AND DIAGNOSIS OF AR-RELATED PATHOLOGIES | HADASIT MEDICAL RESEARCH SERVICES & DEVELOPMENT LTD. (IL) | 2007-05-24 | — | — | WO | disclosed |
| US-7199257-B1 | Process for the synthesis of N-(4-cyano-3-trifluoromethylphenyl)-3-(4-fluorophenylsulfonyl)-2-hydroxy-2-methylpropionamide | RICHTER GEDEON VEGYESZETI GYAR RT. (HU) | 2007-04-03 | — | — | US | disclosed |
| EP-1189898-B1 | PROCESS FOR THE SYNTHESIS OF N-(4-CYANO-3-TRIFLUOROMETHYLPHENYL)-3-(4-FLUOROPHENYLSULPHONYL)-2-HYDROXY-2-METHYLPROPIONAMIDE | RICHTER GEDEON VEGYESZET (HU) | 2003-03-12 | — | — | EP | disclosed |
| EP-1189898-A1 | PROCESS FOR THE SYNTHESIS OF N-(4-CYANO-3-TRIFLUOROMETHYLPHENYL)-3-(4-FLUOROPHENYLSULPHONYL)-2-HYDROXY-2-METHYLPROPIONAMIDE | RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) | 2002-03-27 | — | — | EP | disclosed |
| WO-2001000608-A1 | PROCESS FOR THE SYNTHESIS OF N-(4-CYANO-3-TRIFLUOROMETHYLPHENYL)-3-(4-FLUOROPHENYLSULFONYL)-2-HYDROXY-2-METHYLPROPIONAMIDE | Richter Gedeon Vegyészeti Gyár Rt. (HU) | 2001-01-04 | — | — | WO | disclosed |
| US-4861903-A | Intermediates for preparing optically active carboxylic acids | ZAMBON SPA (IT) | 1989-08-29 | — | — | US | disclosed |