⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3364316 | 0.80 | — | — | |
| SCHEMBL3364312 | 0.78 | — | — | |
| SCHEMBL27487832 | 0.78 | — | — | |
| SCHEMBL1741972 | 0.78 | — | — | |
| SCHEMBL8898373 | 0.77 | SSTR4 (0.36) | — | |
| SCHEMBL11172145 | 0.77 | SSTR4 (0.36) | — | |
| SCHEMBL5461286 | 0.77 | SSTR4 (0.41) | — | |
| SCHEMBL30401427 | 0.74 | SSTR4 (0.41) | — | |
| SCHEMBL10519913 | 0.74 | SSTR4 (0.38) | — | |
| SCHEMBL2899858 | 0.73 | SSTR4 (0.46) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9790352-B2 | Rubber blends containing silicic acid and comprising additives containing sulphur | LANXESS DEUTSCHLAND GMBH (DE) | 2017-10-17 | — | — | US | disclosed |
| US-9758642-B2 | Rubber mixtures containing silicic acid and sulfur-containing additives | LANXESS DEUTSCHLAND GMBH (DE) | 2017-09-12 | — | — | US | disclosed |
| US-20150133581-A1 | RUBBER BLENDS CONTAINING SILICIC ACID AND COMPRISING ADDITIVES CONTAINING SULPHUR | LANXESS DEUTSCHLAND GMBH (DE) | 2015-05-14 | — | — | US | disclosed |
| US-20140142227-A1 | RUBBER MIXTURES CONTAINING SILICIC ACID AND SULFUR-CONTAINING ADDITIVES | LANXESS DEUTSCHLAND GMBH (DE) | 2014-05-22 | — | — | US | disclosed |