⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16111310 | 1.00 | — | — | |
| SCHEMBL21174037 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL21174035 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL1430482 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL21174024 | 0.97 | — | — | |
| SCHEMBL23812136 | 0.82 | PIK3CD (0.31) | — | |
| SCHEMBL12452069 | 0.82 | PIK3CD (0.31) | — | |
| SCHEMBL11003672 | 0.79 | PIK3CD (0.39) | — | |
| SCHEMBL23906378 | 0.78 | — | — | |
| SCHEMBL22399151 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3512849-A1 | 7-SUBSTITUTED 1-ARYL-NAPHTHYRIDINE-3-CARBOXYLIC ACID AMIDES AND USE THEREOF | Bayer Aktiengesellschaft (DE) | 2019-07-24 | — | — | EP | disclosed |
| WO-2018050510-A1 | 7-SUBSTITUTED 1-ARYL-NAPHTHYRIDINE-3-CARBOXYLIC ACID AMIDES AND USE THEREOF | BAYER AKTIENGESELLSCHAFT (DE) | 2018-03-22 | — | — | WO | disclosed |