⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23863911 | 0.79 | — | — | |
| SCHEMBL8528797 | 0.76 | — | — | |
| SCHEMBL82920 | 0.71 | — | — | |
| SCHEMBL3322875 | 0.69 | — | — | |
| SCHEMBL786437 | 0.69 | NOS3 (0.31) | — | |
| SCHEMBL13034847 | 0.67 | — | — | |
| SCHEMBL18595029 | 0.67 | — | — | |
| Ammonia Solution, Strong SCHEMBL28135320 | 0.67 | NOS3 (0.30) | — | |
| Hydrochloric Acid SCHEMBL28150542 | 0.67 | NOS3 (0.30) | — | |
| SCHEMBL4616815 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019028362-A1 | INHIBITORS OF PLASMA KALLIKREIN AND USES THEREOF | DYAX CORP. (US) | 2019-02-07 | — | — | WO | disclosed |
| EP-0781787-B1 | Heavy metal ions-polymer complexes and their use for selective removal of compounds from liquids | BASF AG (DE) | 2000-09-13 | — | — | EP | disclosed |
| EP-0939641-A1 | TOPICAL PRODUCTS AS PROPHYLACTIC OR CURATIVE AGENTS FOR BACTERIAL SKIN INFECTIONS | BASF AKTIENGESELLSCHAFT (DE) | 1999-09-08 | — | — | EP | disclosed |
| WO-1998014199-A1 | TOPICAL PRODUCTS AS PROPHYLACTIC OR CURATIVE AGENTS FOR BACTERIAL SKIN INFECTIONS | BASF AKTIENGESELLSCHAFT (DE) | 1998-04-09 | — | — | WO | disclosed |
| EP-0088964-B1 | PROCESS FOR PREPARING INSOLUBLE, ONLY SLIGHTLY EXPANDABLE POLYMERS OF BASIC VINYL-HETEROCYCLIC COMPOUNDS, AND THEIR USE | BASF Aktiengesellschaft (DE) | 1987-09-02 | — | — | EP | disclosed |