⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14827812 | 1.00 | — | — | |
| SCHEMBL24282239 | 0.86 | CA1 (0.33) | — | |
| SCHEMBL8920712 | 0.80 | — | — | |
| SCHEMBL2132866 | 0.80 | — | — | |
| SCHEMBL3134625 | 0.80 | — | — | |
| SCHEMBL13599945 | 0.80 | — | — | |
| SCHEMBL21673282 | 0.78 | SMN1; SMN2 (0.37) | — | |
| SCHEMBL10725927 | 0.78 | GAA (0.35) | — | |
| SCHEMBL7068821 | 0.75 | — | — | |
| SCHEMBL10726578 | 0.74 | SMN1; SMN2 (0.37) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017050259-A1 | PRODRUGS OF GAMMA-HYDROXYBUTYRIC ACID, COMPOSITIONS AND USES THEREOF | XW LABORATORIES INC. (KY) | 2017-03-30 | — | — | WO | disclosed |
| EP-1446466-A1 | VISCOSITY GROWTH INHIBITION IN OIL ADDITIVE CONCENTRATES | Crompton Corporation (US) | 2004-08-18 | — | — | EP | disclosed |
| WO-2003048281-A1 | VISCOSITY GROWTH INHIBITION IN OIL ADDITIVE CONCENTRATES | CROMPTON CORPORATION (US) | 2003-06-12 | — | — | WO | disclosed |
| WO-2002023274-A2 | PHOTORESIST COMPOSITION | SHIPLEY COMPANY, L.L.C. (US) | 2002-03-21 | — | — | WO | disclosed |
| EP-0312283-A2 | Di-or tripeptide renin inhibitors containing lactam conformational restrictions in ACHPA | MERCK & CO. INC. (US) | 1989-04-19 | — | — | EP | disclosed |
| EP-0026613-A1 | Method of grafting EPM and EPDM polymers | COPOLYMER RUBBER & CHEMICAL CORPORATION (US) | 1981-04-08 | — | — | EP | disclosed |