⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7901748 | 1.00 | — | — | |
| SCHEMBL9806615 | 1.00 | TRPV1 (0.52) | — | |
| SCHEMBL10900926 | 1.00 | TRPV1 (0.52) | — | |
| SCHEMBL10337329 | 1.00 | TRPV1 (0.52) | — | |
| SCHEMBL3422580 | 1.00 | TRPV1 (0.52) | — | |
| SCHEMBL10595123 | 1.00 | TRPV1 (0.52) | — | |
| SCHEMBL23581547 | 1.00 | TRPV1 (0.52) | — | |
| SCHEMBL5277522 | 1.00 | TRPV1 (0.52) | — | |
| Hydrochloric Acid SCHEMBL10344728 | 0.97 | TRPV1 (0.50) | — | |
| Water SCHEMBL9579170 | 0.97 | TRPV1 (0.50) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-8268992-A | — | — | None | — | — | JP | disclosed |
| EP-4257154-A1 | BIOACTIVE SUBSTANCE CONJUGATE, PREPARATION METHOD THEREFOR AND USE THEREOF | Medilink Therapeutics (Suzhou) Co., Ltd. (CN) | 2023-10-11 | — | — | EP | disclosed |
| JP-H08268992-A | OPTICALLY ACTIVE 2-ALKOXYCARBONYLAMINO-1-ARYLETHANOL COMPOUND AND ITS PRODUCTION | KAWAKEN FINE CHEM CO LTD | 1996-10-15 | — | — | JP | disclosed |