⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20336263 | 0.88 | NLRP3 (0.35) | — | |
| SCHEMBL20336294 | 0.86 | HDAC11 (0.32) | — | |
| SCHEMBL20336278 | 0.85 | C5AR1 (0.36) | — | |
| SCHEMBL20336288 | 0.84 | HDAC11 (0.33) | — | |
| SCHEMBL20942765 | 0.82 | C5AR1 (0.30) | — | |
| SCHEMBL20336276 | 0.79 | — | — | |
| SCHEMBL18329486 | 0.79 | C5AR1 (0.37) | — | |
| SCHEMBL20336259 | 0.77 | HDAC11 (0.32) | — | |
| SCHEMBL20336262 | 0.77 | HDAC11 (0.32) | — | |
| SCHEMBL18329483 | 0.75 | CDK2 (0.44) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10894798-B2 | Substituted dihydropyrrolopyrazole derivative | UBE INDUSTRIES, LTD. (JP) | 2021-01-19 | — | — | US | disclosed |
| US-20190256531-A1 | SUBSTITUTED DIHYDROPYRROLOPYRAZOLE DERIVATIVE | UBE INDUSTRIES, LTD. (JP) | 2019-08-22 | — | — | US | disclosed |
| US-10273252-B2 | Substituted dihydropyrrolopyrazole derivative | UBE INDUSTRIES, LTD. (JP) | 2019-04-30 | — | — | US | disclosed |
| US-20180186818-A1 | SUBSTITUTED DIHYDROPYRROLOPYRAZOLE DERIVATIVE | UBE INDUSTRIES, LTD. (JP) | 2018-07-05 | — | — | US | disclosed |