⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8768900 | 0.73 | — | — | |
| SCHEMBL8668678 | 0.71 | MMP1 (0.33) | — | |
| SCHEMBL1534444 | 0.71 | MMP1 (0.33) | — | |
| SCHEMBL8442006 | 0.70 | — | — | |
| SCHEMBL8841758 | 0.70 | PPARD (0.39) | — | |
| SCHEMBL2814234 | 0.70 | PPARD (0.48) | — | |
| SCHEMBL6562094 | 0.69 | PPARD (0.46) | — | |
| SCHEMBL6210416 | 0.69 | S1PR2 (0.37) | — | |
| SCHEMBL1291624 | 0.67 | — | — | |
| SCHEMBL18686716 | 0.67 | PPARD (0.44) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101132785-A | N-halogenated amino acids and N, N-dihalogenated amino acids in combination with hypohalous acids | NOVABAY PHARMACEUTICALS INC (US) | 2008-02-27 | — | — | CN | claimed |
| US-20140227201-A1 | Antimicrobial Gel Formulations | NOVABAY PHARMACEUTICALS, INC. | 2014-08-14 | — | — | US | disclosed |
| US-20100076089-A1 | ANTIMICROBIAL GEL FORMULATIONS | NOVABAY PHARMACEUTICALS, INC. | 2010-03-25 | — | — | US | disclosed |