⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2852883 | 0.77 | — | — | |
| SCHEMBL3401234 | 0.69 | ALDH1A1 (0.35) | — | |
| SCHEMBL4048169 | 0.67 | — | — | |
| SCHEMBL21443128 | 0.65 | — | — | |
| SCHEMBL4778593 | 0.64 | — | — | |
| SCHEMBL302078 | 0.64 | SELP (0.35) | — | |
| SCHEMBL201580 | 0.64 | — | — | |
| SCHEMBL965817 | 0.64 | — | — | |
| SCHEMBL4521757 | 0.64 | — | — | |
| 1,4-Butanediol SCHEMBL18642509 | 0.61 | SMN1; SMN2 (0.58) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8399489-B2 | Antibacterial piperdine derivatives | ASTRAZENECA AB (GB) | 2013-03-19 | — | — | US | disclosed |
| US-20100179150-A1 | ANTIBACTERIAL PIPERDINE DERIVATIVES | ASTRAZENECA AB (SE) | 2010-07-15 | — | — | US | disclosed |
| EP-0691129-A2 | Thiazolidone and pyrrolidinone compounds for inhibiting bone loss | ELI LILLY AND COMPANY (US) | 1996-01-10 | — | — | EP | disclosed |
| US-5476865-A | Administering rhodanine derivatives | ELI LILLY AND COMPANY (US) | 1995-12-19 | — | — | US | disclosed |
| US-5356887-A | Bone resorption, osteoporosis | MERCK & CO., INC. (US) | 1994-10-18 | — | — | US | disclosed |