⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1022671 | 0.85 | ALDH1A1 (0.37) | — | |
| Bicarbonate SCHEMBL25229752 | 0.79 | LMNA (0.39) | — | |
| Bicarbonate SCHEMBL27611180 | 0.79 | LMNA (0.39) | — | |
| SCHEMBL35719 | 0.78 | — | — | |
| SCHEMBL1802495 | 0.78 | ALDH1A1 (0.32) | — | |
| Cyclohexane SCHEMBL1801941 | 0.78 | ALDH1A1 (0.32) | — | |
| Cyclopropane SCHEMBL1799907 | 0.78 | ALDH1A1 (0.32) | — | |
| SCHEMBL28166859 | 0.76 | TSHR (0.36) | — | |
| SCHEMBL27515182 | 0.76 | — | — | |
| Ethylene SCHEMBL167404 | 0.76 | LMNA (0.33) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6277908-B1 | COMPOSITION COMPRISING POLYOLEFIN POLYMER, METAL HYDROXIDE OR HYDRATED METAL SALT, POLYOLEFIN BASED POLYMER GRAFTED OR COPOLYMERIZED WITH VINYL BEARING SPECIES, ORGANOPOLYSILOXANE COMPOUND AND AMINE COMPOUND | BOREALS A/S (DK) | 2001-08-21 | — | — | US | claimed |
| EP-0530940-B1 | Non-halogenated flame-retardant resin composition and wires and cables coated therewith | HITACHI CABLE (JP) | 2000-12-20 | — | — | EP | claimed |
| US-20210289794-A1 | COMPOSITIONS AND RELATED METHODS FOR AGRICULTURE | FLAGSHIP PIONEERING INNOVATIONS V, INC. | 2021-09-23 | — | — | US | disclosed |
| CN-109286020-B | Negative pole piece and secondary battery | 宁德时代新能源科技股份有限公司 | 2021-03-30 | — | — | CN | disclosed |
| US-6277908-B1 | COMPOSITION COMPRISING POLYOLEFIN POLYMER, METAL HYDROXIDE OR HYDRATED METAL SALT, POLYOLEFIN BASED POLYMER GRAFTED OR COPOLYMERIZED WITH VINYL BEARING SPECIES, ORGANOPOLYSILOXANE COMPOUND AND AMINE COMPOUND | BOREALS A/S (DK) | 2001-08-21 | — | — | US | disclosed |
| EP-0530940-B1 | Non-halogenated flame-retardant resin composition and wires and cables coated therewith | HITACHI CABLE (JP) | 2000-12-20 | — | — | EP | disclosed |
| EP-0530940-A1 | Non-halogenated flame-retardant resin composition and wires and cables coated therewith | HITACHI CABLE, LTD. (JP) | 1993-03-10 | — | — | EP | disclosed |