⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4254393 | 0.95 | — | — | |
| SCHEMBL21796153 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL2898083 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL19639026 | 0.80 | — | — | |
| SCHEMBL334727 | 0.73 | CTSD (0.33) | — | |
| SCHEMBL9472583 | 0.71 | CTSD (0.32) | — | |
| SCHEMBL52936 | 0.71 | — | — | |
| Carbon Monoxide SCHEMBL9218219 | 0.65 | — | — | |
| SCHEMBL3002779 | 0.64 | — | — | |
| SCHEMBL560183 | 0.63 | — | — |
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-20100197938-A1 | Process for producing indole compoud | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 2010-08-05 | — | — | US | disclosed |
| US-20070083053-A1 | Process for producing indole compound | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 2007-04-12 | — | — | US | disclosed |