⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL134837 | 0.97 | — | — | |
| SCHEMBL9988919 | 0.66 | THRB (0.32) | — | |
| SCHEMBL9347615 | 0.65 | — | — | |
| SCHEMBL16538259 | 0.64 | — | — | |
| SCHEMBL78668 | 0.62 | — | — | |
| SCHEMBL17797447 | 0.62 | — | — | |
| SCHEMBL17956895 | 0.60 | — | — | |
| SCHEMBL9347624 | 0.60 | — | — | |
| SCHEMBL1705892 | 0.59 | — | — | |
| SCHEMBL9344912 | 0.59 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1558542-B1 | A METHOD FOR GRINDING CEMENT COMPRISING AMINE-CONTAINING CEMENT PROCESSING ADDITIVES | GRACE W R & CO (US) | 2012-03-07 | — | — | EP | disclosed |
| EP-1558542-B1 | A METHOD FOR GRINDING CEMENT COMPRISING AMINE-CONTAINING CEMENT PROCESSING ADDITIVES | GRACE W R & CO (US) | 2012-03-07 | — | — | EP | disclosed |
| US-7160384-B2 | Amine-containing cement processing additives | W.R. GRACE & CO.-CONN. (US) | 2007-01-09 | — | — | US | disclosed |
| US-20060086291-A1 | Amine-containing cement processing additives | VERIFI LLC | 2006-04-27 | — | — | US | disclosed |
| EP-1558542-A1 | AMINE-CONTAINING CEMENT PROCESSING ADDITIVES | W.R. Grace & Co.-Conn. (US) | 2005-08-03 | — | — | EP | disclosed |
| EP-1558542-A1 | AMINE-CONTAINING CEMENT PROCESSING ADDITIVES | W.R. Grace & Co.-Conn. (US) | 2005-08-03 | — | — | EP | disclosed |
| WO-2004033386-A1 | AMINE-CONTAINING CEMENT PROCESSING ADDITIVES | W.R. GRACE & CO.-CONN (US) | 2004-04-22 | — | — | WO | disclosed |
| WO-2004033386-A1 | AMINE-CONTAINING CEMENT PROCESSING ADDITIVES | W.R. GRACE & CO.-CONN (US) | 2004-04-22 | — | — | WO | disclosed |