⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL369199 | 0.83 | LMNA (0.51) | — | |
| SCHEMBL176304 | 0.81 | LMNA (0.57) | — | |
| SCHEMBL14930282 | 0.74 | MCHR1 (0.45) | — | |
| SCHEMBL29183081 | 0.73 | CA1 (0.51) | — | |
| SCHEMBL30931234 | 0.73 | CA1 (0.51) | — | |
| SCHEMBL10034987 | 0.72 | F10 (0.49) | — | |
| SCHEMBL10035061 | 0.72 | F10 (0.47) | — | |
| SCHEMBL29712633 | 0.71 | TMPRSS4 (0.67) | — | |
| SCHEMBL7257671 | 0.71 | GAA (0.64) | — | |
| SCHEMBL22516047 | 0.70 | CA1 (0.57) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8097759-B2 | Inflammatory cytokine release inhibitor | INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) | 2012-01-17 | — | — | US | disclosed |
| US-20100274051-A1 | INFLAMMATORY CYTOKINE RELEASE INHIBITOR | INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) | 2010-10-28 | — | — | US | disclosed |