⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8993425 | 0.81 | — | — | |
| SCHEMBL4956261 | 0.67 | — | — | |
| SCHEMBL7088781 | 0.67 | — | — | |
| SCHEMBL11395914 | 0.61 | — | — | |
| SCHEMBL3374433 | 0.61 | — | — | |
| SCHEMBL10921873 | 0.58 | — | — | |
| SCHEMBL6246608 | 0.55 | — | — | |
| Hydrazine SCHEMBL4391026 | 0.54 | — | — | |
| SCHEMBL514533 | 0.54 | TSHR (0.35) | — | |
| SCHEMBL514534 | 0.54 | TSHR (0.35) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110520127-B | Piperidinyl-substituted and piperazinyl-substituted heteroaromatic carboxamides as modulators of GPR6 | 武田药品工业株式会社 | 2023-05-16 | — | — | CN | disclosed |
| CN-105884758-B | Tricyclic compounds and their use in medicine | 广东东阳光药业有限公司 | 2019-12-10 | — | — | CN | disclosed |
| CN-104744491-A | Benzoxazepin Pi3k Inhibitor Compounds And Methods Of Use | HOFFMAN LA ROCHE AG | 2015-07-01 | — | — | CN | disclosed |
| CN-102762576-B | Benzoxazepine PI3K inhibitor compounds and methods of use | HOFFMANN LA ROCHE | 2015-04-22 | — | — | CN | disclosed |
| US-5504077-A | ANALGESICS | G. D. SEARLE & CO. (US) | 1996-04-02 | — | — | US | disclosed |