⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8969846 | 0.75 | — | — | |
| SCHEMBL8969278 | 0.69 | — | — | |
| SCHEMBL8969275 | 0.69 | — | — | |
| SCHEMBL8969165 | 0.49 | — | — | |
| SCHEMBL28589006 | 0.49 | TSHR (0.44) | — | |
| SCHEMBL2932603 | 0.48 | AHR (0.52) | — | |
| SCHEMBL2458581 | 0.46 | SMN1; SMN2 (0.38) | — | |
| SCHEMBL16938678 | 0.46 | LMNA (0.42) | — | |
| Hydrogen Sulfide SCHEMBL11666785 | 0.46 | AHR (0.50) | — | |
| SCHEMBL11476631 | 0.46 | LMNA (0.42) | — |
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-5486512-A | LEARNING ENHANCEMENT | WARNER-LAMBERT COMPANY (US) | 1996-01-23 | — | — | US | disclosed |
| WO-1993003034-A1 | QUINAZOLINE DERIVATIVES AS ACETYLCHOLINESTERASE INHIBITORS | WARNER-LAMBERT COMPANY (US) | 1993-02-18 | — | — | WO | disclosed |