⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21034805 | 1.00 | — | — | |
| SCHEMBL21034412 | 0.80 | — | — | |
| SCHEMBL24178936 | 0.75 | FNTA (0.45) | — | |
| SCHEMBL24178854 | 0.75 | FNTA (0.45) | — | |
| SCHEMBL4297372 | 0.75 | — | — | |
| SCHEMBL12852243 | 0.75 | — | — | |
| SCHEMBL12519877 | 0.75 | — | — | |
| SCHEMBL8352097 | 0.74 | PTGS1 (0.55) | — | |
| SCHEMBL21035301 | 0.74 | DPP4 (0.57) | — | |
| Hydrochloric Acid SCHEMBL10358937 | 0.74 | FNTA (0.44) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10961189-B2 | Spiro-lactam NMDA receptor modulators and uses thereof | APTINYX INC. (US) | 2021-03-30 | — | — | US | disclosed |
| US-20190161442-A1 | SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF | TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) | 2019-05-30 | — | — | US | disclosed |