⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1492004 | 0.79 | THRB (0.33) | — | |
| SCHEMBL25470339 | 0.77 | — | — | |
| SCHEMBL18896570 | 0.72 | — | — | |
| SCHEMBL515193 | 0.70 | — | — | |
| SCHEMBL11294895 | 0.70 | ALDH1A1 (0.33) | — | |
| SCHEMBL21561098 | 0.69 | — | — | |
| SCHEMBL21450644 | 0.67 | TDP1 (0.32) | — | |
| SCHEMBL21705043 | 0.67 | — | — | |
| SCHEMBL21720233 | 0.67 | — | — | |
| SCHEMBL25147689 | 0.67 | — | — |
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-5633357-A | Synthesis of carboxylic acid glucuronides | SYNTHETIC TECHNOLOGY CORPORATION (US) | 1997-05-27 | — | — | US | claimed |
| US-5292899-A | Synthesis of 11-nor-Δ-9-tetrahydrocannabinol-9-carboxylic acid glucuronide | SYNTHETIC TECHNOLOGY CORPORATION (US) | 1994-03-08 | — | — | US | claimed |
| EP-1337536-B1 | CATIONIC GROUP-3 CATALYST SYSTEM | EXXONMOBIL CHEM PATENTS INC (US) | 2012-09-12 | — | — | EP | disclosed |
| US-7390861-B2 | Cationic group-3 catalyst system | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2008-06-24 | — | — | US | disclosed |
| US-20040033891-A1 | Cationic group-3 catalyst system | EXXONMOBIL CHEMICAL PATENTS INC. | 2004-02-19 | — | — | US | disclosed |
| US-5633357-A | Synthesis of carboxylic acid glucuronides | SYNTHETIC TECHNOLOGY CORPORATION (US) | 1997-05-27 | — | — | US | disclosed |
| US-5292899-A | Synthesis of 11-nor-Δ-9-tetrahydrocannabinol-9-carboxylic acid glucuronide | SYNTHETIC TECHNOLOGY CORPORATION (US) | 1994-03-08 | — | — | US | disclosed |