⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6705482 | 0.85 | KDM4E (0.31) | — | |
| SCHEMBL6215321 | 0.78 | NSD2 (0.48) | — | |
| SCHEMBL6703741 | 0.75 | PPARG (0.31) | — | |
| SCHEMBL13719383 | 0.75 | KDM4E (0.31) | — | |
| SCHEMBL11766943 | 0.74 | KMT2A (0.41) | — | |
| SCHEMBL1473414 | 0.74 | KMT2A (0.41) | — | |
| SCHEMBL7175398 | 0.74 | KMT2A (0.41) | — | |
| SCHEMBL4352284 | 0.74 | KMT2A (0.41) | — | |
| SCHEMBL1739727 | 0.74 | KMT2A (0.41) | — | |
| SCHEMBL17122004 | 0.72 | NSD2 (0.33) | — |
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-0161904-B1 | TETRAHYDROFURANYL AND TETRAHYDROTHIENYL SUBSTITUTED ETHERS | E.R. Squibb & Sons, Inc. (US) | 1989-10-18 | — | — | EP | disclosed |
| US-4638011-A | CARDIOVASCULAR DISORDERS, THROMBOLYTIC DISEASE | E. R. SQUIBB & SONS, INC. (US) | 1987-01-20 | — | — | US | disclosed |
| EP-0159528-A1 | Tetrahydrofuranyl substituted prostaglandin analogs | E.R. Squibb & Sons, Inc. (US) | 1985-10-30 | — | — | EP | disclosed |
| US-4542155-A | THROMBOSIS, VASODILATION, BRONCHODILATORS | E. R. SQUIBB & SONS, INC. (US) | 1985-09-17 | — | — | US | disclosed |