⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25403595 | 0.75 | — | — | |
| SCHEMBL2171251 | 0.73 | — | — | |
| SCHEMBL5493507 | 0.73 | L3MBTL1 (0.32) | — | |
| SCHEMBL13449774 | 0.73 | TSHR (0.33) | — | |
| SCHEMBL6535318 | 0.73 | — | — | |
| SCHEMBL15370335 | 0.71 | — | — | |
| SCHEMBL6870972 | 0.71 | L3MBTL1 (0.31) | — | |
| SCHEMBL7620432 | 0.71 | — | — | |
| SCHEMBL8896831 | 0.71 | L3MBTL1 (0.31) | — | |
| SCHEMBL12225477 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4981854-A | BACTERICIDES, ANIMAL GROWTH REGUALTORS | BAYER AKTIENGESELLSCHAFT (DE) | 1991-01-01 | — | — | US | claimed |
| US-4980353-A | BACTERICIDES, ANIMAL GROWTH REGULATORS | BAYER AKTIENGESELLSCHAFT (DE) | 1990-12-25 | — | — | US | claimed |
| US-7273886-B2 | For therapy and prophylaxis of clotting disorders; useful for inhibiting serine protease enzymes, such as TF/factor VIIa, factor Xa, thrombin and kallikrein | GENENTECH, INC. (US) | 2007-09-25 | — | — | US | disclosed |