⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1120435 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL3881741 | 0.75 | SOS1 (0.52) | — | |
| Hydrochloric Acid SCHEMBL1992388 | 0.75 | SOS1 (0.52) | — | |
| Iodide SCHEMBL22031615 | 0.75 | SOS1 (0.52) | — | |
| Ammonia Solution, Strong SCHEMBL27616014 | 0.75 | SOS1 (0.52) | — | |
| SCHEMBL1157614 | 0.73 | SOS1 (0.50) | — | |
| SCHEMBL28273821 | 0.73 | SOS1 (0.33) | — | |
| SCHEMBL25508539 | 0.71 | — | — | |
| SCHEMBL20528085 | 0.71 | SOS1 (0.48) | — | |
| SCHEMBL8142778 | 0.71 | SOS1 (0.32) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100240894-A1 | METHOD FOR PRODUCING AMINES FROM GLYCERIN | BASF SE (DE) | 2010-09-23 | — | — | US | disclosed |
| CN-101842345-A | Method for producing amines from glycerol | BASF SE | 2010-09-22 | — | — | CN | disclosed |
| EP-0789062-B1 | WATER-ABSORBENT RESIN DISPERSION AND POLYURETHANE COMPOSITION | SANYO CHEMICAL IND LTD (JP) | 2003-01-22 | — | — | EP | disclosed |
| US-5994421-A | CROSSLINKING | SANYO CHEMICAL INDUSTRIES, LTD. (JP) | 1999-11-30 | — | — | US | disclosed |
| EP-0789062-A1 | WATER-ABSORBENT RESIN DISPERSION AND POLYURETHANE COMPOSITION | SANYO CHEMICAL INDUSTRIES, LTD. (JP) | 1997-08-13 | — | — | EP | disclosed |