⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5256593 | 1.00 | — | — | |
| SCHEMBL4700854 | 1.00 | — | — | |
| SCHEMBL6635960 | 0.93 | — | — | |
| SCHEMBL29043448 | 0.84 | SLC6A2 (0.41) | — | |
| SCHEMBL489437 | 0.79 | — | — | |
| SCHEMBL1104709 | 0.79 | — | — | |
| SCHEMBL4762840 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL25316432 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL1317388 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL25314974 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1963326-A1 | SUBSTITUTED PYRROLO-PYRAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS | NERVIANO MEDICAL SCIENCES S.r.l. (IT) | 2008-09-03 | — | — | EP | disclosed |
| WO-2007068637-A1 | SUBSTITUTED PYRROLO-PYRAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS | NERVIANO MEDICAL SCIENCES S.R.L. (IT) | 2007-06-21 | — | — | WO | disclosed |