⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9601137 | 0.83 | — | — | |
| SCHEMBL5949009 | 0.81 | PLA2G1B (0.39) | — | |
| SCHEMBL118906 | 0.79 | PLA2G1B (0.42) | — | |
| SCHEMBL29286819 | 0.79 | PLA2G1B (0.42) | — | |
| SCHEMBL5948622 | 0.78 | ALDH1A1 (0.37) | — | |
| Bromide SCHEMBL28907094 | 0.77 | PLA2G1B (0.41) | — | |
| Hydrochloric Acid SCHEMBL27987612 | 0.77 | PLA2G1B (0.41) | — | |
| SCHEMBL3107959 | 0.77 | TSHR (0.41) | — | |
| SCHEMBL3109470 | 0.75 | TSHR (0.45) | — | |
| SCHEMBL8493071 | 0.74 | ENPEP (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4351768-A | CARBONLESS, DUPLICATION, INDOLE DYES | STERLING DRUG INC. (US) | 1982-09-28 | — | — | US | disclosed |
| US-4322352-A | Indolyl phthalide compounds | STERLING DRUG INC. (US) | 1982-03-30 | — | — | US | disclosed |
| US-4307018-A | CHROMOGENS FOR COPYING SYSTEMS | STERLING DRUG INC. (US) | 1981-12-22 | — | — | US | disclosed |
| US-4251446-A | COLOR PRECURSORS | STERLING DRUG INC. (US) | 1981-02-17 | — | — | US | disclosed |
| US-4189171-A | PRESSURE SENSITIVE, THERMAL AND HECTOGRAPHIC SYSTEMS | STERLING DRUG INC. (US) | 1980-02-19 | — | — | US | disclosed |