⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3455746 | 1.00 | — | — | |
| SCHEMBL20284520 | 1.00 | — | — | |
| Cyclopropane SCHEMBL11122692 | 0.97 | ALDH1A1 (0.36) | — | |
| SCHEMBL20609355 | 0.97 | ALDH1A1 (0.36) | — | |
| Bromide SCHEMBL7065185 | 0.97 | — | — | |
| SCHEMBL12808264 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL4283459 | 0.97 | — | — | |
| SCHEMBL3611735 | 0.92 | — | — | |
| SCHEMBL14747926 | 0.92 | — | — | |
| SCHEMBL8757826 | 0.92 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2057156-B1 | 2-METHYLMORPHOLINE PYRIDO-,PYRAZO- AND PYRIMIDO-PYRIMIDINE DERIVATIVES AS MTOR INHIBITORS | KUDOS PHARM LTD (GB) | 2017-02-01 | — | — | EP | disclosed |
| WO-2006090169-A1 | 2,4-DIAMINO-PYRIDOPYRIMIDINE DERIVATIVES AND THEIR USE AS MTOR INHIBITORS | KUDOS PHARMACEUTICALS LIMITED (GB) | 2006-08-31 | — | — | WO | disclosed |