⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26083491 | 1.00 | — | — | |
| SCHEMBL24469108 | 0.88 | PIN1 (0.30) | — | |
| SCHEMBL26083489 | 0.81 | MAPT (0.32) | — | |
| SCHEMBL30368338 | 0.81 | MAPT (0.32) | — | |
| SCHEMBL30493660 | 0.76 | — | — | |
| SCHEMBL26083471 | 0.75 | NPC1 (0.31) | — | |
| SCHEMBL29809732 | 0.75 | ATR (0.34) | — | |
| SCHEMBL26083492 | 0.75 | ATR (0.34) | — | |
| SCHEMBL26326384 | 0.73 | NPC1 (0.33) | — | |
| SCHEMBL30368183 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116323612-A | Tricyclic urea compounds as JAK 2V 617F inhibitors | 因赛特公司 | 2023-06-23 | — | — | CN | disclosed |
| EP-4175719-A1 | TRICYCLIC UREA COMPOUNDS AS JAK2 V617F INHIBITORS | Incyte Corporation (US) | 2023-05-10 | — | — | EP | disclosed |