⚠ 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 | |
|---|---|---|---|---|
| Taurine SCHEMBL30191395 | 0.97 | — | — | |
| Taurine SCHEMBL42632 | 0.97 | BLM (1.00) | — | |
| Taurine SCHEMBL23068 | 0.97 | — | — | |
| Taurine SCHEMBL30179154 | 0.97 | — | — | |
| Taurine SCHEMBL3667691 | 0.93 | — | — | |
| Taurine SCHEMBL19438470 | 0.93 | — | — | |
| Taurine SCHEMBL10626136 | 0.93 | — | — | |
| Taurine SCHEMBL923628 | 0.93 | — | — | |
| Taurine SCHEMBL466027 | 0.93 | — | — | |
| Taurine SCHEMBL11449240 | 0.93 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102647997-A | Inhibiting bacterial infection and biofilm formation | KCI LICENSING INC | 2012-08-22 | — | — | CN | disclosed |
| US-4504575-A | Heat-developable film containing silver sulfonate physical developer | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1985-03-12 | — | — | US | disclosed |