⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL295012 | 0.78 | — | — | |
| SCHEMBL21518237 | 0.75 | PRKD3 (0.42) | — | |
| SCHEMBL5867195 | 0.74 | — | — | |
| SCHEMBL27797890 | 0.73 | — | — | |
| SCHEMBL491421 | 0.73 | — | — | |
| SCHEMBL27797964 | 0.73 | — | — | |
| SCHEMBL10438663 | 0.72 | PRKD3 (0.51) | — | |
| SCHEMBL8086425 | 0.72 | PRKD3 (0.51) | — | |
| SCHEMBL8080756 | 0.72 | PRKD3 (0.51) | — | |
| SCHEMBL5996738 | 0.72 | PRKD3 (0.51) | — |
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 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20060025434-A1 | Therapeutic agents for drug/substance dependence | TORAY INDUSTRIES, INC. (JP) | 2006-02-02 | — | — | US | claimed |
| EP-0531382-A1 | N-SUBSTITUTED-1,2,4-TRIAZOLONE COMPOUNDS FOR TREATMENT OF CARDIOVASCULAR DISORDERS | G.D. SEARLE & CO. (US) | 1993-03-17 | — | — | EP | claimed |
| US-4855311-A | DERIVATIVES OF BENZOISOTHIAZOLE OXIME | AGRO-KANESHO CO., LTD. (JP) | 1989-08-08 | — | — | US | claimed |
| US-9375008-B2 | Pyrazole compounds for controlling invertebrate pests | BASF SE (DE) | 2016-06-28 | — | — | US | disclosed |
| US-9247745-B2 | Substituted pyridazines for controlling invertebrate pests | BASF SE (DE) | 2016-02-02 | — | — | US | disclosed |
| EP-2342196-B1 | PYRAZOLE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS | BASF SE (DE) | 2015-07-29 | — | — | EP | disclosed |
| US-9040537-B2 | Pyridazine compounds for controlling invertebrate pests | BASF SE (DE) | 2015-05-26 | — | — | US | disclosed |
| EP-2595981-B1 | NOVEL HETARYL (THIO)CARBOXAMIDE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS | BASF SE (DE) | 2014-12-10 | — | — | EP | disclosed |
| US-20140142111-A1 | Pyrazole Compounds for Controlling Invertebrate Pests | BASF SE (DE) | 2014-05-22 | — | — | US | disclosed |
| US-8729083-B2 | Pyrazole compounds for controlling invertebrate pests | BASF SE (DE) | 2014-05-20 | — | — | US | disclosed |
| EP-2595981-A1 | NOVEL HETARYL (THIO)CARBOXAMIDE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS | BASF SE (DE) | 2013-05-29 | — | — | EP | disclosed |
| EP-0913376-A1 | Process for the preparation of cyclohexanones | MERCK PATENT GmbH (DE) | 1999-05-06 | — | — | EP | disclosed |
| US-5760197-A | YELLOW PIGMENT FOR DYEING TEXTILES | DYSTAR JAPAN LTD. (JP) | 1998-06-02 | — | — | US | disclosed |
| US-5719155-A | CARDIOVASCULAR DISORDERS | JAPAN TOBACCO INC. (JP) | 1998-02-17 | — | — | US | disclosed |
| EP-0752452-A1 | Hydroxyquinolone-monoazo dyes, their preparation and use | DyStar Japan Ltd. (JP) | 1997-01-08 | — | — | EP | disclosed |
| EP-0677519-A1 | CHROMAN DERIVATIVE AND MEDICINAL USE THEREOF | Japan Tobacco Inc. (JP) | 1995-10-18 | — | — | EP | disclosed |
| US-5116956-A | POLYAZO DYE COMPOUNDS HAVING VINYLSULFONE TYPE AND PYRIDINIUM TYPE FIBER REACTIVE GROUPS | SUMITOMO CHEMICAL CO., LTD. (JP) | 1992-05-26 | — | — | US | disclosed |
| US-5047432-A | Antidepressants | THE BOOTS COMPANY PLC (GB) | 1991-09-10 | — | — | US | disclosed |
| US-4925879-A | ANTIDEPRESSANTS | BOOTS COMPANY, PLC (GB) | 1990-05-15 | — | — | US | disclosed |
| EP-0191542-A1 | Arylcyclobutylalkyl amines and their use as antidepressive medicines | The Boots Company PLC (GB) | 1986-08-20 | — | — | EP | disclosed |