⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2345796 | 0.82 | — | — | |
| SCHEMBL7756140 | 0.79 | — | — | |
| SCHEMBL8167230 | 0.76 | — | — | |
| SCHEMBL6901425 | 0.76 | — | — | |
| SCHEMBL27811357 | 0.76 | — | — | |
| SCHEMBL20526071 | 0.76 | — | — | |
| SCHEMBL195749 | 0.76 | — | — | |
| SCHEMBL466770 | 0.74 | — | — | |
| SCHEMBL466769 | 0.74 | — | — | |
| SCHEMBL9054897 | 0.72 | TRPV1 (0.31) | — |
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-105594011-A | Wound body of battery packaging material | DAINIPPON PRINTING CO LTD | 2016-05-18 | — | — | CN | disclosed |
| WO-2012014085-A2 | USES OF CIMIRACEMATE AND RELATED COMPOUNDS FOR TREATING INFLAMMATION AND MODULATING IMMUNE RESPONSES | PURAPHARM INTERNATIONAL (HK) LIMITED (CN) | 2012-02-02 | — | — | WO | disclosed |
| US-20040132994-A1 | Cephem compounds | FUJISAWA PHARMACEUTICAL CO., LTD (JP) | 2004-07-08 | — | — | US | disclosed |