⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3477324 | 0.81 | — | — | |
| SCHEMBL824115 | 0.79 | — | — | |
| SCHEMBL23114345 | 0.79 | KDM4E (0.38) | — | |
| SCHEMBL12423926 | 0.79 | KDM4E (0.38) | — | |
| SCHEMBL23132323 | 0.79 | KDM4E (0.38) | — | |
| SCHEMBL25147585 | 0.78 | SMN1; SMN2 (0.47) | — | |
| SCHEMBL3476561 | 0.78 | SMN1; SMN2 (0.47) | — | |
| SCHEMBL25147587 | 0.78 | SMN1; SMN2 (0.47) | — | |
| SCHEMBL25803364 | 0.78 | — | — | |
| SCHEMBL22788776 | 0.75 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230133132-A1 | NAMPT MODULATORS | CYTOKINETICS, INC. | 2023-05-04 | — | — | US | disclosed |
| US-9656996-B2 | Fused heterocyclic compound, preparation method therefor, pharmaceutical composition, and uses thereof | SHANGHAI YINGLI PHARMACEUTICAL CO., LTD. (CN) | 2017-05-23 | — | — | US | disclosed |
| US-20160244432-A1 | FUSED HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTCIAL COMPOSITION, AND USES THEREOF | SHANGHAI YINGLI PHARMACEUTICAL CO., LTD. (CN) | 2016-08-25 | — | — | US | disclosed |