⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL124301 | 0.90 | TSHR (0.31) | — | |
| SCHEMBL124302 | 0.90 | TSHR (0.31) | — | |
| SCHEMBL10486697 | 0.79 | TSHR (0.39) | — | |
| SCHEMBL15782743 | 0.73 | — | — | |
| SCHEMBL2939029 | 0.71 | TSHR (0.35) | — | |
| SCHEMBL2939027 | 0.71 | TSHR (0.35) | — | |
| SCHEMBL11491772 | 0.71 | — | — | |
| SCHEMBL11491778 | 0.71 | — | — | |
| SCHEMBL35543 | 0.71 | — | — | |
| SCHEMBL35542 | 0.71 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4604455-A | REACTING TWO PRIMARY AMINES WITH SULFURYL CHLORIDE, OXIDIZING MIXTURE OF SULFAMIDE PRODUCTS | PENNWALT CORPORATION (US) | 1986-08-05 | — | — | US | claimed |
| WO-2012028501-A1 | METHOD FOR PRODUCING NITRILE RUBBERS IN ORGANIC SOLVENTS | LANXESS DEUTSCHLAND GMBH (DE) | 2012-03-08 | — | — | WO | disclosed |
| WO-2012028503-A1 | METHOD FOR PRODUCING NITRILE RUBBERS IN ORGANIC SOLVENTS | LANXESS DEUTSCHLAND GMBH (DE) | 2012-03-08 | — | — | WO | disclosed |
| WO-2012028506-A1 | RUBBER BLENDS CONSISTING OF DIFFERENT NITRILE RUBBERS | LANXESS DEUTSCHLAND GMBH (DE) | 2012-03-08 | — | — | WO | disclosed |
| EP-2423235-A1 | Method for producing nitrile rubbers in organic solvents | LANXESS Deutschland GmbH (DE) | 2012-02-29 | — | — | EP | disclosed |
| EP-2423238-A1 | Method for producing nitrile rubbers in organic solvents | LANXESS Deutschland GmbH (DE) | 2012-02-29 | — | — | EP | disclosed |
| EP-2423234-A1 | Rubber blends from different nitrile rubbers | LANXESS Deutschland GmbH (DE) | 2012-02-29 | — | — | EP | disclosed |
| WO-2011032832-A1 | NITRILE RUBBERS AND PRODUCTION THEREOF IN ORGANIC SOLVENTS | LANXESS DEUTSCHLAND GMBH (DE) | 2011-03-24 | — | — | WO | disclosed |
| US-4831096-A | VARYING THERMAL STABILITIES | PENNWALT CORPORATION (US) | 1989-05-16 | — | — | US | disclosed |
| US-4604455-A | REACTING TWO PRIMARY AMINES WITH SULFURYL CHLORIDE, OXIDIZING MIXTURE OF SULFAMIDE PRODUCTS | PENNWALT CORPORATION (US) | 1986-08-05 | — | — | US | disclosed |