⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL27687745 | 0.98 | — | — | |
| SCHEMBL7991058 | 0.82 | — | — | |
| SCHEMBL1145851 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL8693728 | 0.70 | HIF1A (0.36) | — | |
| SCHEMBL28222860 | 0.67 | L3MBTL1 (0.41) | — | |
| SCHEMBL12473383 | 0.67 | — | — | |
| SCHEMBL4618500 | 0.67 | — | — | |
| SCHEMBL10225989 | 0.67 | — | — | |
| SCHEMBL7592261 | 0.66 | MAPT (0.48) | — | |
| SCHEMBL5395907 | 0.66 | — | — |
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-6248765-B1 | ANTIINFLAMMATORY AGENTS; HYPOTENSIVE AGENTS | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICAL (FR) | 2001-06-19 | — | — | US | claimed |
| CN-106967213-B | Eight-arm polyethylene glycol, preparation method, functionalized derivative and modified biologically-relevant substance | 厦门赛诺邦格生物科技股份有限公司 | 2019-11-05 | — | — | CN | disclosed |
| CN-106967213-A | Eight-arm polyethylene glycol, preparation method, functionalized derivative and modified biologically-relevant substance | 厦门赛诺邦格生物科技股份有限公司 | 2017-07-21 | — | — | CN | disclosed |
| CN-104911921-B | A kind of outdoor shoe material synthetic polyurethane leather | 晋江市池店镇娇鹏贸易有限公司 | 2016-08-31 | — | — | CN | disclosed |