⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL49436 | 0.96 | — | — | |
| Benzene SCHEMBL28128746 | 0.96 | ALDH1A1 (0.43) | — | |
| SCHEMBL10697823 | 0.92 | — | — | |
| Bromide SCHEMBL901517 | 0.92 | — | — | |
| SCHEMBL2299471 | 0.92 | — | — | |
| SCHEMBL9660749 | 0.92 | ALDH1A1 (0.40) | — | |
| SCHEMBL10477500 | 0.92 | — | — | |
| SCHEMBL20597177 | 0.92 | ALDH1A1 (0.40) | — | |
| Water SCHEMBL22231695 | 0.92 | — | — | |
| SCHEMBL11667486 | 0.92 | — | — |
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-20230255966-A1 | A COMBINATION OF A CBP/P300 BROMODOMAIN INHIBITOR AND AN EGFR INHIBITOR FOR USE IN TREATING EGFR-MUTANT NSCLC | TOLREMO THERAPEUTICS AG (CH) | 2023-08-17 | — | — | US | disclosed |
| US-20230233558-A1 | COMBINATION OF A CBP/P300 BROMODOMAIN INHIBITOR AND A KRAS INHIBITOR FOR THE TREATMENT OF CANCER | TOLREMO THERAPEUTICS AG (CH) | 2023-07-27 | — | — | US | disclosed |
| EP-3334714-A1 | PROCESS FOR MAKING BERAPROST | United Therapeutics Corporation (US) | 2018-06-20 | — | — | EP | disclosed |
| CN-101730656-B | Method for the production of hydrogen from ammonia borane | 卡娜塔化学技术股份有限公司 | 2017-05-03 | — | — | CN | disclosed |
| WO-2017027706-A1 | PROCESS FOR MAKING BERAPROST | UNITED THERAPEUTICS CORPORATION (US) | 2017-02-16 | — | — | WO | disclosed |
| CN-103946249-B | Conjugated diolefin polymer and manufacture method thereof | 日本瑞翁株式会社 | 2016-08-24 | — | — | CN | disclosed |
| CN-101012387-B | Technique for manufacturing liquid fuel from highly effective cellulose biomass | HUAIBEI ZHONGRUN BIOENERGY TECHNOLOGY DEV CO LTD | 2011-05-11 | — | — | CN | disclosed |
| CN-101730656-A | Method for the production of hydrogen from ammonia borane | KANATA CHEMICAL TECHNOLOGIES I | 2010-06-09 | — | — | CN | disclosed |
| CN-101012387-A | Technique for manufacturing liquid fuel from highly effective cellulose biomass | HUAIBEI ZHONGRUN BIOENERGY TEC (CN) | 2007-08-08 | — | — | CN | disclosed |