⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2688348 | 0.77 | — | — | |
| SCHEMBL8341547 | 0.77 | STAT3 (0.35) | — | |
| SCHEMBL1604156 | 0.77 | — | — | |
| SCHEMBL6817519 | 0.75 | — | — | |
| SCHEMBL6817521 | 0.75 | — | — | |
| SCHEMBL6817518 | 0.75 | — | — | |
| SCHEMBL10041393 | 0.73 | — | — | |
| SCHEMBL8341723 | 0.73 | STAT3 (0.30) | — | |
| SCHEMBL9070725 | 0.69 | — | — | |
| SCHEMBL9010728 | 0.67 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5945410-A | ADMINISTERED TO TREAT POSTMANOPAUSAL OSTEOPOROSIS, LOW BONE TURNOVER OSTEOPOROSIS, OSTEOMALACIA AND RENAL OSTEODYSTROPHY | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 1999-08-31 | — | — | US | disclosed |
| US-5936133-A | USEFUL IN THEIR ABILITY TO MOBILIZE CALCIUM ION FROM THE BONE; ANTICARCINOGENIC AGENTS; USED FOR TREATING OSTEOPOROSIS, PROPHYLAXIS AND AUTOIMMUNE DISORDERS | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 1999-08-10 | — | — | US | disclosed |
| US-5843928-A | 2-alkylidene-19-nor-vitamin D compounds | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 1998-12-01 | — | — | US | disclosed |