⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7640423 | 0.78 | NPC1 (0.32) | — | |
| SCHEMBL18261224 | 0.76 | ALDH1A1 (0.34) | — | |
| SCHEMBL30028170 | 0.76 | ALDH1A1 (0.34) | — | |
| SCHEMBL7181552 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL1538380 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL7719173 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL6003856 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL27862673 | 0.75 | ALDH1A1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL540421 | 0.73 | ALDH1A1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL5086023 | 0.73 | ALDH1A1 (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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6881493-B2 | Polyolefins and uses thereof | ATOFINA RESEARCH S.A. (BE) | 2005-04-19 | — | — | US | disclosed |
| EP-1049741-B1 | POLYOLEFIN COMPOSITIONS AND USES THEREOF | TOTAL PETROCHEMICALS RES FELUY (BE) | 2005-03-30 | — | — | EP | disclosed |
| US-6448349-B1 | STEREORIGID METALLOCENE FOR BLOCK GAS PHASE POLYMERIZING OLEFINS HAVING THREE OR MORE CARBON ATOMS | FINA RESEARCH, S.A. (BE) | 2002-09-10 | — | — | US | disclosed |
| US-6348272-B1 | Polyolefins and uses thereof | FINA RESEARCH, S.A. (BE) | 2002-02-19 | — | — | US | disclosed |
| EP-0910591-B1 | SYNDIOTACTIC/ATACTIC BLOCK POLYOLEFINS, CATALYSTS AND PROCESSES FOR PRODUCING THE SAME | FINA RESEARCH (BE) | 2001-03-21 | — | — | EP | disclosed |
| EP-1049741-A2 | POLYOLEFINS AND USES THEREOF | FINA RESEARCH S.A. (BE) | 2000-11-08 | — | — | EP | disclosed |
| WO-1999037711-A2 | POLYOLEFINS AND USES THEREOF | FINA RESEARCH S.A. (BE) | 1999-07-29 | — | — | WO | disclosed |
| EP-0931814-A1 | Polyolefins and uses thereof | FINA RESEARCH S.A. (BE) | 1999-07-28 | — | — | EP | disclosed |
| EP-0818475-A1 | Syndiotactic/atactic block polyolefins, catalysts and processes for producing the same | FINA RESEARCH S.A. (BE) | 1998-01-14 | — | — | EP | disclosed |