⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3535148 | 0.81 | BRD4 (0.32) | — | |
| SCHEMBL12937983 | 0.79 | LMNA (0.48) | — | |
| SCHEMBL12824192 | 0.79 | LMNA (0.48) | — | |
| SCHEMBL10140521 | 0.79 | LMNA (0.48) | — | |
| SCHEMBL28997648 | 0.79 | SRC (0.33) | — | |
| SCHEMBL8526255 | 0.77 | MEN1 (0.31) | — | |
| SCHEMBL27397292 | 0.77 | HSD17B10 (0.47) | — | |
| SCHEMBL27577102 | 0.74 | ALDH1A1 (0.33) | — | |
| SCHEMBL6615625 | 0.74 | KMT2A (0.41) | — | |
| SCHEMBL27874655 | 0.74 | FFAR2 (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20070259907-A1 | ARYL AND ARYLALKYLENYL SUBSTITUTED THIAZOLOQUINOLINES AND THIAZOLONAPHTHYRIDINES | 3M INNOVATIVE PROPERTIES COMPANY | 2007-11-08 | — | — | US | disclosed |