⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19454603 | 0.86 | — | — | |
| SCHEMBL24071283 | 0.81 | — | — | |
| SCHEMBL1425989 | 0.77 | — | — | |
| Ammonia Solution, Strong SCHEMBL7241067 | 0.74 | — | — | |
| SCHEMBL16618523 | 0.72 | — | — | |
| SCHEMBL19155427 | 0.72 | — | — | |
| SCHEMBL9380704 | 0.72 | — | — | |
| SCHEMBL20438417 | 0.72 | — | — | |
| SCHEMBL16187287 | 0.72 | TSHR (0.32) | — | |
| SCHEMBL3029732 | 0.72 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20150105540-A1 | DRUG-CONJUGATES WITH A TARGETING MOLECULE AND TWO DIFFERENT DRUGS | SORRENTO THERAPEUTICS INC. (US) | 2015-04-16 | — | — | US | disclosed |