⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL933257 | 0.92 | — | — | |
| Hydrochloric Acid SCHEMBL21408262 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL27863821 | 0.88 | — | — | |
| Formaldehyde SCHEMBL27690920 | 0.88 | — | — | |
| SCHEMBL4436164 | 0.82 | — | — | |
| SCHEMBL28312655 | 0.79 | — | — | |
| Dimethylformamide SCHEMBL27679289 | 0.79 | TSHR (0.30) | — | |
| SCHEMBL27674320 | 0.77 | — | — | |
| Hydrochlorthiazide SCHEMBL28226326 | 0.75 | — | — | |
| Benzamide SCHEMBL27951698 | 0.75 | POLB (0.48) | — |
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-102482284-B | Pyrazolopyrimidine compounds and methods as JAK inhibitors | GENENTECH, INC. (US) | 2015-11-25 | — | — | CN | disclosed |
| CN-104910161-A | Pyrazolopyrimidine JAK inhibitor compounds and methods | GENENTECH INC | 2015-09-16 | — | — | CN | disclosed |