⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1674701 | 0.76 | — | — | |
| SCHEMBL197155 | 0.76 | CA12 (0.35) | — | |
| SCHEMBL1965518 | 0.74 | — | — | |
| SCHEMBL3431812 | 0.74 | — | — | |
| SCHEMBL3431780 | 0.74 | — | — | |
| SCHEMBL2066424 | 0.74 | — | — | |
| SCHEMBL2067221 | 0.74 | CYP11B1 (0.35) | — | |
| SCHEMBL7221022 | 0.73 | KDM4E (0.49) | — | |
| SCHEMBL2067793 | 0.72 | LMNA (0.41) | — | |
| SCHEMBL3514942 | 0.71 | KDM4E (0.42) | — |
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-2010146351-A1 | INDOLYLMETHYL-MORPHOLINE DERIVATIVES AS KINASE INHIBITORS | UCB PHARMA S.A. (BE) | 2010-12-23 | — | — | WO | disclosed |