⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8441630 | 0.83 | — | — | |
| SCHEMBL22734890 | 0.81 | — | — | |
| SCHEMBL1690475 | 0.74 | ALDH1A1 (0.33) | — | |
| SCHEMBL1690477 | 0.74 | ALDH1A1 (0.33) | — | |
| SCHEMBL19667913 | 0.73 | — | — | |
| SCHEMBL4620736 | 0.73 | — | — | |
| SCHEMBL15869748 | 0.71 | — | — | |
| SCHEMBL3917541 | 0.70 | — | — | |
| SCHEMBL4620218 | 0.70 | — | — | |
| SCHEMBL490711 | 0.69 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117794510-A | Cosmetic composition | 花王株式会社 | 2024-03-29 | — | — | CN | disclosed |
| CN-117750938-A | Hair cosmetic composition | 花王株式会社 | 2024-03-22 | — | — | CN | disclosed |
| EP-2536722-A1 | BICYCLIC COMPOUNDS AND THEIR USES AS DUAL C-SRC / JAK INHIBITORS | Debiopharm S.A. (CH) | 2012-12-26 | — | — | EP | disclosed |
| EP-2520570-A1 | AMINOPYRIDINE COMPOUND | Ube Industries, Ltd. (JP) | 2012-11-07 | — | — | EP | disclosed |
| US-20120259123-A1 | AMINOPYRIDINE COMPOUND | UBE INDUSTRIES, LTD. (JP) | 2012-10-11 | — | — | US | disclosed |
| WO-2011101806-A1 | BICYCLIC COMPOUNDS AND THEIR USES AS DUAL C-SRC / JAK INHIBITORS | DEBIOPHARM S.A. (CH) | 2011-08-25 | — | — | WO | disclosed |
| WO-2010025871-A1 | 4-HALOGEN ALKYL-SUBSTITUTED DIAMINOPYRIMIDINES FOR USE AS FUNGICIDES | BAYER CROPSCIENCE AG (DE) | 2010-03-11 | — | — | WO | disclosed |
| EP-2161259-A1 | 4-Haloalkyl substituted Diaminopyrimidine | Bayer CropScience AG (DE) | 2010-03-10 | — | — | EP | disclosed |