⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5524772 | 0.92 | — | — | |
| SCHEMBL3821733 | 0.89 | ALDH1A1 (0.32) | — | |
| SCHEMBL1218829 | 0.89 | — | — | |
| SCHEMBL4825588 | 0.86 | ALDH1A1 (0.30) | — | |
| SCHEMBL2929595 | 0.84 | — | — | |
| SCHEMBL20485310 | 0.72 | NCF1 (0.39) | — | |
| SCHEMBL7622675 | 0.69 | — | — | |
| SCHEMBL3675466 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL9004739 | 0.67 | RAD52 (0.33) | — | |
| SCHEMBL20485255 | 0.67 | NOS1 (0.31) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116648248-A | Aromatic compound, pharmaceutical composition containing same and application thereof | 成都茵创园医药科技有限公司 | 2023-08-25 | — | — | CN | claimed |
| CN-117858707-A | CBL-B modulators and uses thereof | 林伯士克莱奥公司 | 2024-04-09 | — | — | CN | disclosed |
| CN-116648248-A | Aromatic compound, pharmaceutical composition containing same and application thereof | 成都茵创园医药科技有限公司 | 2023-08-25 | — | — | CN | disclosed |
| CN-102344457-B | Spirocyclic aminoquinolones as GSK-3 inhibitors | KYORIN SEIYAKU KK | 2015-07-22 | — | — | CN | disclosed |
| CN-102344457-A | Spirocyclic aminoquinolones as gsk-3 inhibitors | KYORIN SEIYAKU KK | 2012-02-08 | — | — | CN | disclosed |
| CN-101855229-A | Spirocyclic aminoquinolones as GSK-3 inhibitors | ACTIVX BIOSCIENCES INC | 2010-10-06 | — | — | CN | disclosed |
| EP-1874769-A1 | NOVEL AZA- HETEROCYCLES SERVING AS KINASE INHIBITORS | Merck Patent GmbH (DE) | 2008-01-09 | — | — | EP | disclosed |
| WO-2006114180-A1 | NOVEL AZA- HETEROCYCLES SERVING AS KINASE INHIBITORS | MERCK PATENT GMBH (DE) | 2006-11-02 | — | — | WO | disclosed |