⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8406279 | 0.82 | — | — | |
| SCHEMBL3108095 | 0.81 | — | — | |
| SCHEMBL8406419 | 0.79 | OPRM1 (0.31) | — | |
| SCHEMBL10875388 | 0.78 | ALOX15 (0.31) | — | |
| SCHEMBL3100148 | 0.76 | GBA1 (0.31) | — | |
| SCHEMBL25676461 | 0.76 | GBA1 (0.31) | — | |
| SCHEMBL8406282 | 0.75 | — | — | |
| SCHEMBL3108930 | 0.74 | PIK3CD (0.32) | — | |
| SCHEMBL20977146 | 0.74 | SIGMAR1 (0.33) | — | |
| SCHEMBL10385634 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8765083-B2 | Acid gas absorbent composition | NALCO COMPANY (US) | 2014-07-01 | — | — | US | disclosed |
| US-8765083-B2 | Acid gas absorbent composition | NALCO COMPANY (US) | 2014-07-01 | — | — | US | disclosed |
| US-8765951-B2 | Acid gas absorbent composition | NALCO COMPANY (US) | 2014-07-01 | — | — | US | disclosed |
| US-8765951-B2 | Acid gas absorbent composition | NALCO COMPANY (US) | 2014-07-01 | — | — | US | disclosed |
| US-20130240782-A1 | ACID GAS ABSORBENT COMPOSITION | CHAMPIONX LLC | 2013-09-19 | — | — | US | disclosed |
| US-20130240782-A1 | ACID GAS ABSORBENT COMPOSITION | CHAMPIONX LLC | 2013-09-19 | — | — | US | disclosed |
| US-20120128561-A1 | ACID GAS ABSORBENT COMPOSITION | US SYNTHETIC CORPORATION | 2012-05-24 | — | — | US | disclosed |
| US-20120128561-A1 | ACID GAS ABSORBENT COMPOSITION | US SYNTHETIC CORPORATION | 2012-05-24 | — | — | US | disclosed |