⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19268245 | 0.55 | — | — | |
| Guanidine SCHEMBL1395011 | 0.48 | LMNA (0.30) | — | |
| Guanidine SCHEMBL5613752 | 0.45 | — | — | |
| Guanidine SCHEMBL165720 | 0.45 | NOS2 (0.42) | — | |
| Guanidine SCHEMBL11330173 | 0.45 | — | — | |
| Guanidine SCHEMBL29983942 | 0.45 | — | — | |
| Guanidine SCHEMBL2003 | 0.45 | — | — | |
| Guanidine SCHEMBL649219 | 0.44 | — | — | |
| SCHEMBL3265453 | 0.41 | — | — | |
| Guanidine SCHEMBL25310528 | 0.41 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003060192-A1 | NON-TOXIC CORROSION-PROTECTION RINSES AND SEALS BASED ON COBALT | UNIVERSITY OF DAYTON (US) | 2003-07-24 | — | — | WO | disclosed |