⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12899463 | 0.83 | — | — | |
| SCHEMBL28862977 | 0.83 | — | — | |
| SCHEMBL12335126 | 0.72 | — | — | |
| SCHEMBL22248861 | 0.72 | — | — | |
| SCHEMBL26242387 | 0.72 | — | — | |
| SCHEMBL17920103 | 0.72 | — | — | |
| SCHEMBL16827257 | 0.72 | — | — | |
| SCHEMBL22313289 | 0.72 | — | — | |
| SCHEMBL1794387 | 0.72 | — | — | |
| SCHEMBL14490643 | 0.72 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101165033-A | Method for synthesizing 4-hexen-1-ol | SHANGHAI PERFUME RES INST (CN) | 2008-04-23 | — | — | CN | claimed |
| US-11427578-B1 | Substituted pyrrolopyridine-derivatives | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2022-08-30 | — | — | US | disclosed |
| EP-3655406-A1 | SUBSTITUTED PYRROLOPYRIDINE-DERIVATIVES | Bayer Pharma Aktiengesellschaft (DE) | 2020-05-27 | — | — | EP | disclosed |
| US-10280164-B2 | Pyrazolopyridone compounds and uses thereof | INCYTE CORPORATION (US) | 2019-05-07 | — | — | US | disclosed |
| WO-2019016071-A1 | SUBSTITUTED PYRROLOPYRIDINE-DERIVATIVES | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2019-01-24 | — | — | WO | disclosed |
| WO-2018049191-A1 | PYRAZOLOPYRIDONE DERIVATIVES AS HPK1 MODULATORS AND USES THEREOF FOR THE TREATMENT OF CANCER | INCYTE CORPORATION (US) | 2018-03-15 | — | — | WO | disclosed |
| US-20180072719-A1 | PYRAZOLOPYRIDONE COMPOUNDS AND USES THEREOF | INCYTE CORPORATION | 2018-03-15 | — | — | US | disclosed |
| CN-101165033-A | Method for synthesizing 4-hexen-1-ol | SHANGHAI PERFUME RES INST (CN) | 2008-04-23 | — | — | CN | disclosed |
| US-20040256743-A1 | Method for producing organic compound by substituting halogen atoms | MITSUI CHEMICALS, INC. (JP) | 2004-12-23 | — | — | US | disclosed |
| EP-1486479-A1 | Method for producing organic compounds by substituting halogen atoms | MITSUI CHEMICALS, INC. (JP) | 2004-12-15 | — | — | EP | disclosed |