⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4620652 | 0.92 | CRBN (0.45) | — | |
| SCHEMBL4619038 | 0.83 | OR51E2 (0.48) | — | |
| SCHEMBL116223 | 0.81 | — | — | |
| SCHEMBL4618617 | 0.81 | CRBN (0.50) | — | |
| Charcoal, Activated SCHEMBL30614618 | 0.79 | — | — | |
| Methane SCHEMBL10972248 | 0.79 | — | — | |
| Ethylene SCHEMBL27712961 | 0.77 | — | — | |
| SCHEMBL4620260 | 0.76 | OR51E2 (0.46) | — | |
| SCHEMBL11308019 | 0.72 | — | — | |
| SCHEMBL4621492 | 0.72 | CRBN (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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1019391-A1 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | MERCK & CO. INC. (US) | 2000-07-19 | — | — | EP | claimed |
| WO-1999018096-A1 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 1999-04-15 | — | — | WO | claimed |
| US-6960595-B2 | 5-6 to 5-7 Heterobicycles as factor Xa inhibitors | BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) | 2005-11-01 | — | — | US | disclosed |
| US-20030018023-A1 | 5-6 or 5-7 Heterobicycles as Factor Xa inhibitors | BRISTOL-MYERS SQUIBB PHARMA COMPANY | 2003-01-23 | — | — | US | disclosed |
| US-6127390-A | ANTITUMOR AGENTS INHIBITING FARNESYL-PROTEIN TRANSFERASE, FOR TREATING CANCER | MERCK & CO., INC. (US) | 2000-10-03 | — | — | US | disclosed |
| EP-1019391-A1 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | MERCK & CO. INC. (US) | 2000-07-19 | — | — | EP | disclosed |
| WO-1999018096-A1 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 1999-04-15 | — | — | WO | disclosed |
| US-3945984-A | Preparing polyamides by anionic polymerization of lactams | CCESKOSLOVENSKA AKADEMIE VED (CS) | 1976-03-23 | — | — | US | disclosed |
| US-3941754-A | Preparing polyamides by anionic polymerization of lactams | CESKOSLOVENSKA AKADEMIE VED (CS) | 1976-03-02 | — | — | US | disclosed |