⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL56964 | 0.97 | — | — | |
| SCHEMBL28782488 | 0.83 | — | — | |
| Ether SCHEMBL737487 | 0.81 | ALDH1A1 (0.40) | — | |
| SCHEMBL16091260 | 0.81 | TSHR (0.57) | — | |
| SCHEMBL702148 | 0.81 | — | — | |
| SCHEMBL5596038 | 0.80 | TSHR (0.41) | — | |
| SCHEMBL14275234 | 0.79 | TSHR (0.55) | — | |
| SCHEMBL7056188 | 0.78 | — | — | |
| SCHEMBL7290302 | 0.78 | — | — | |
| SCHEMBL30229751 | 0.78 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0576445-B1 | A COMPOSITION FOR USE IN WASHING AND CLEANSING VULCANIZATION MOLDS | SAN MARTINO SPA (IT) | 1996-05-15 | — | — | EP | claimed |
| EP-0576445-A1 | A COMPOSITION FOR USE IN WASHING AND CLEANSING VULCANIZATION MOLDS. | SILVANI ANTINCENDI SPA (IT) | 1994-01-05 | — | — | EP | claimed |
| WO-1992016346-A1 | A COMPOSITION FOR USE IN WASHING AND CLEANSING VULCANIZATION MOLDS | SILVANI ANTINCENDI S.P.A (IT) | 1992-10-01 | — | — | WO | claimed |
| EP-2032535-B1 | SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS | SANOFI SA (FR) | 2012-08-01 | — | — | EP | disclosed |
| US-20080076760-A1 | 2,3,4,5-TETRAHYDRO-1H-1,5-BENZODIAZEPINE DERIVATIVE AND MEDICINAL COMPOSITION | WAKAMOTO PHARMACEUTICAL CO., LTD (JP) | 2008-03-27 | — | — | US | disclosed |
| EP-0576445-B1 | A COMPOSITION FOR USE IN WASHING AND CLEANSING VULCANIZATION MOLDS | SAN MARTINO SPA (IT) | 1996-05-15 | — | — | EP | disclosed |
| US-5468422-A | Composition for use in washing and cleansing vulcanization molds | SILVANI ANTINCEDI (IT) | 1995-11-21 | — | — | US | disclosed |
| EP-0576445-A1 | A COMPOSITION FOR USE IN WASHING AND CLEANSING VULCANIZATION MOLDS. | SILVANI ANTINCENDI SPA (IT) | 1994-01-05 | — | — | EP | disclosed |
| WO-1992016346-A1 | A COMPOSITION FOR USE IN WASHING AND CLEANSING VULCANIZATION MOLDS | SILVANI ANTINCENDI S.P.A (IT) | 1992-10-01 | — | — | WO | disclosed |