⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9119534 | 0.99 | — | — | |
| SCHEMBL10345775 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL9693396 | 0.90 | — | — | |
| SCHEMBL9531297 | 0.86 | — | — | |
| Iodide SCHEMBL9693978 | 0.85 | — | — | |
| Iodide SCHEMBL9696117 | 0.85 | — | — | |
| Iodide SCHEMBL9695469 | 0.85 | — | — | |
| Hydrochloric Acid SCHEMBL9528547 | 0.85 | — | — | |
| Hydrochloric Acid SCHEMBL9528920 | 0.85 | — | — | |
| Hydrochloric Acid SCHEMBL9528539 | 0.85 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0469477-B1 | Antiallergic combination | HOFFMANN LA ROCHE (CH) | 1995-09-20 | — | — | EP | claimed |
| EP-0157609-B1 | LIPID DERIVATIVES THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1992-10-14 | — | — | EP | claimed |
| US-5025005-A | Preventive or therapeutic agents for circulatory diseases, allergic disorders; antineoplastic agent; inhibitor for platelet activating factor | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1991-06-18 | — | — | US | claimed |
| US-5854279-A | Therapeutic agent for dermatosis | EISAI CO., LTD (JP) | 1998-12-29 | — | — | US | disclosed |
| EP-0811379-A1 | Therapeutic agent for dermatosis | Eisai Co., Ltd. (JP) | 1997-12-10 | — | — | EP | disclosed |