⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7939604 | 0.61 | — | — | |
| SCHEMBL418352 | 0.57 | BRD4 (0.38) | — | |
| SCHEMBL18396239 | 0.56 | — | — | |
| SCHEMBL18395671 | 0.56 | — | — | |
| SCHEMBL27598312 | 0.54 | RECQL (0.34) | — | |
| SCHEMBL1077183 | 0.54 | CHRNB2 (0.46) | — | |
| SCHEMBL1077181 | 0.54 | CHRNB2 (0.46) | — | |
| SCHEMBL27858737 | 0.52 | RECQL (0.32) | — | |
| SCHEMBL21044908 | 0.52 | — | — | |
| SCHEMBL2204413 | 0.51 | ALDH1A1 (0.55) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3997547-A | Phenylimino-2H-quinolizines | MORTON-NORWICH PRODUCTS, INC. (US) | 1976-12-14 | — | — | US | disclosed |