⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5278090 | 0.70 | — | — | |
| SCHEMBL5277294 | 0.64 | HCAR3 (0.32) | — | |
| SCHEMBL10197127 | 0.60 | SMPD3 (0.32) | — | |
| SCHEMBL20077039 | 0.59 | — | — | |
| SCHEMBL19604174 | 0.55 | — | — | |
| SCHEMBL10029554 | 0.55 | — | — | |
| SCHEMBL24975332 | 0.50 | P2RX7 (0.30) | — | |
| SCHEMBL12890926 | 0.47 | CYP1A2 (0.31) | — | |
| SCHEMBL11802553 | 0.42 | HRH4 (0.34) | — | |
| SCHEMBL3265453 | 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 |
|---|---|---|---|---|---|---|---|
| US-20230242546-A1 | SUBSTITUTED PYRIDINES, PYRIDAZINES, PYRIMIDINES, AND 1,2,4-TRIAZINES AS TYK2 INHIBITORS | SUDO BIOSCIENCES LIMITED (GB) | 2023-08-03 | — | — | US | disclosed |