⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8706148 | 0.77 | — | — | |
| SCHEMBL8706144 | 0.77 | — | — | |
| SCHEMBL28007762 | 0.75 | — | — | |
| SCHEMBL5732242 | 0.74 | — | — | |
| SCHEMBL931681 | 0.74 | — | — | |
| SCHEMBL9459892 | 0.74 | — | — | |
| SCHEMBL27493253 | 0.71 | — | — | |
| SCHEMBL31232912 | 0.69 | CES2 (0.38) | — | |
| Butyric Acid SCHEMBL7505108 | 0.69 | HDAC3 (0.72) | — | |
| SCHEMBL11598743 | 0.67 | CES2 (0.41) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0891353-A4 | INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE | MERCK & CO INC (US) | 2001-08-08 | — | — | EP | disclosed |
| EP-0891353-A1 | INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE | Merck & Co., Inc. (US) | 1999-01-20 | — | — | EP | disclosed |
| WO-1997036892-A1 | INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 1997-10-09 | — | — | WO | disclosed |
| WO-1996039137-A1 | INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 1996-12-12 | — | — | WO | disclosed |