⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3278584 | 0.84 | — | — | |
| SCHEMBL44550 | 0.80 | — | — | |
| SCHEMBL9535944 | 0.80 | — | — | |
| SCHEMBL9587624 | 0.79 | TSHR (0.36) | — | |
| SCHEMBL1110971 | 0.78 | — | — | |
| SCHEMBL140788 | 0.78 | — | — | |
| SCHEMBL15211144 | 0.73 | — | — | |
| SCHEMBL21437491 | 0.72 | — | — | |
| SCHEMBL10541133 | 0.70 | — | — | |
| SCHEMBL2427968 | 0.70 | — | — |
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-117327000-A | Biphenyl tetrahydropyrrole compound and preparation method and application thereof | 海南因瑞生物医药科技有限公司 | 2024-01-02 | — | — | CN | claimed |
| CN-115232129-B | PARP1 selective inhibitor and preparation method and application thereof | 上海闻耐医药科技有限公司 | 2023-12-01 | — | — | CN | claimed |
| CN-115232129-A | PARP1 selective inhibitor and preparation method and application thereof | 上海闻耐医药科技有限公司 | 2022-10-25 | — | — | CN | claimed |
| CN-117327000-A | Biphenyl tetrahydropyrrole compound and preparation method and application thereof | 海南因瑞生物医药科技有限公司 | 2024-01-02 | — | — | CN | disclosed |
| CN-115232129-B | PARP1 selective inhibitor and preparation method and application thereof | 上海闻耐医药科技有限公司 | 2023-12-01 | — | — | CN | disclosed |
| WO-2023141852-A1 | CDK2 INHIBITORS, PREPARATION METHOD THEREFOR AND USE THEREOF | 益方生物科技(上海)股份有限公司 | 2023-08-03 | — | — | WO | disclosed |
| CN-115232129-A | PARP1 selective inhibitor and preparation method and application thereof | 上海闻耐医药科技有限公司 | 2022-10-25 | — | — | CN | disclosed |
| US-20080033033-A1 | 8-AZAPROSTAGLANDIN DERIVATIVES AND MEDICAL USE THEREOF | ONO PHARMACEUTICAL CO., LTD. | 2008-02-07 | — | — | US | disclosed |
| US-7256211-B1 | 8-azaprostaglandin derivatives and medical use thereof | ONO PHARMACEUTICAL CO., LTD. (JP) | 2007-08-14 | — | — | US | disclosed |
| EP-1586564-A1 | 8-AZAPROSTAGLANDIN DERIVATIVES AND MEDICINAL USES THEREOF | ONO PHARMACEUTICAL CO., LTD. (JP) | 2005-10-19 | — | — | EP | disclosed |
| US-5262420-A | Phenylalkylpyridines | IDEMITSU KOSAN CO., LTD. (JP) | 1993-11-16 | — | — | US | disclosed |
| EP-0383950-A1 | PYRIDINE DERIVATIVES AND INSECTICIDAL AND MITICIDAL AGENT CONTAINING SAME AS ACTIVE INGREDIENT | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1990-08-29 | — | — | EP | disclosed |