⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL827776 | 0.82 | — | — | |
| SCHEMBL12493518 | 0.78 | — | — | |
| SCHEMBL16599613 | 0.78 | ALDH1A1 (0.33) | — | |
| SCHEMBL5041398 | 0.71 | MMP1 (0.44) | — | |
| SCHEMBL827212 | 0.69 | — | — | |
| SCHEMBL21303330 | 0.68 | — | — | |
| SCHEMBL28369821 | 0.68 | MMP1 (0.34) | — | |
| SCHEMBL2600449 | 0.68 | TP53 (0.34) | — | |
| SCHEMBL1326408 | 0.68 | TP53 (0.41) | — | |
| SCHEMBL5389188 | 0.67 | FFAR1 (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3169671-A1 | SUBSTITUTED UREA DERIVATIVES AND PHARMACEUTICAL USES THEREOF | Sunshine Lake Pharma Co., Ltd. (CN) | 2017-05-24 | — | — | EP | disclosed |
| WO-2016008433-A1 | SUBSTITUTED UREA DERIVATIVES AND PHARMACEUTICAL USES THEREOF | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2016-01-21 | — | — | WO | disclosed |
| WO-2015043492-A1 | SUBSTITUTED UREA DERIVATIVES AND USES THEREOF IN MEDICINE | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2015-04-02 | — | — | WO | disclosed |