⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL619108 | 0.74 | — | — | |
| SCHEMBL203426 | 0.71 | — | — | |
| SCHEMBL892670 | 0.69 | TSHR (0.31) | — | |
| SCHEMBL410240 | 0.69 | — | — | |
| SCHEMBL892584 | 0.69 | TSHR (0.31) | — | |
| SCHEMBL18221771 | 0.69 | — | — | |
| SCHEMBL11746501 | 0.67 | — | — | |
| SCHEMBL18221782 | 0.67 | — | — | |
| SCHEMBL15018256 | 0.67 | TSHR (0.38) | — | |
| SCHEMBL22319096 | 0.65 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111393478-B | Synthesis method of adefovir | 深圳市宝安区新材料研究院 | 2023-05-26 | — | — | CN | disclosed |
| CN-106146851-B | Photocurable composition and cured product containing same | 信越化学工业株式会社 | 2020-10-23 | — | — | CN | disclosed |
| CN-111393478-A | Synthetic method of medicine for treating pneumonia infected by new coronavirus COVID-19 | 深圳市前海博扬研究院有限公司 | 2020-07-10 | — | — | CN | disclosed |
| EP-3093303-B1 | PHOTOCURABLE COMPOSITION AND CURED PRODUCT | SHINETSU CHEMICAL CO (JP) | 2019-08-28 | — | — | EP | disclosed |
| EP-3353190-A1 | C4-MODIFIED OLEANOLIC ACID DERIVATIVES FOR INHIBITION OF IL-17 AND OTHER USES | Reata Pharmaceuticals, Inc. (US) | 2018-08-01 | — | — | EP | disclosed |
| WO-2017053868-A1 | C4-MODIFIED OLEANOLIC ACID DERIVATIVES FOR INHIBITION OF IL-17 AND OTHER USES | REATA PHARMACEUTICAL, INC. (US) | 2017-03-30 | — | — | WO | disclosed |
| US-20160333171-A1 | PHOTOCURABLE COMPOSITION AND CURED PRODUCT | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2016-11-17 | — | — | US | disclosed |
| EP-3093303-A1 | PHOTOCURABLE COMPOSITION AND CURED PRODUCT | Shin-Etsu Chemical Co., Ltd. (JP) | 2016-11-16 | — | — | EP | disclosed |
| US-8802637-B2 | Benzylbenzene derivatives and methods of use | THERACOS, INC. (US) | 2014-08-12 | — | — | US | disclosed |
| US-20140031300-A1 | BENZYLBENZENE DERIVATIVES AND METHODS OF USE | THERACOS, INC. (US) | 2014-01-30 | — | — | US | disclosed |
| EP-1329160-A2 | 4-ACYLAMINOPYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-07-23 | — | — | EP | disclosed |
| EP-0225739-B1 | 2-2-DIMETHYL-3-HYDROXY-3-PROPARGYL-4-(1,2,4-TRIAZOLE-1-YL -BUTANE DERIVATIVES AS PLANT GROWTH REGULATORS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1990-10-24 | — | — | EP | disclosed |