⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8733036 | 0.89 | — | — | |
| SCHEMBL29470897 | 0.84 | — | — | |
| SCHEMBL548121 | 0.82 | STAT3 (0.35) | — | |
| SCHEMBL5703319 | 0.82 | STAT3 (0.31) | — | |
| SCHEMBL554303 | 0.81 | ALOX5 (0.31) | — | |
| SCHEMBL548131 | 0.80 | STAT3 (0.39) | — | |
| SCHEMBL6910095 | 0.80 | STAT3 (0.39) | — | |
| SCHEMBL549041 | 0.80 | STAT3 (0.39) | — | |
| SCHEMBL10428730 | 0.80 | STAT3 (0.39) | — | |
| SCHEMBL29395797 | 0.80 | STAT3 (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-5313106-A | — | — | None | — | — | JP | disclosed |
| EP-0722959-B1 | Highly oxygen-permeable heat-resistant material | MENICON CO LTD (JP) | 1998-04-08 | — | — | EP | disclosed |
| US-5587445-A | Highly oxygen-permeable heat-resistant material | MENICON CO., LTD. (JP) | 1996-12-24 | — | — | US | disclosed |
| EP-0722959-A2 | Highly oxygen-permeable heat-resistant material | Menicon Co., Ltd. (JP) | 1996-07-24 | — | — | EP | disclosed |
| JP-H05313106-A | CONTACT LENS MATERIAL | MENICON CO LTD | 1993-11-26 | — | — | JP | disclosed |