⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16860509 | 0.74 | — | — | |
| SCHEMBL6629001 | 0.72 | — | — | |
| SCHEMBL18811551 | 0.72 | — | — | |
| SCHEMBL19650299 | 0.72 | — | — | |
| SCHEMBL21663765 | 0.70 | — | — | |
| SCHEMBL5172921 | 0.70 | — | — | |
| SCHEMBL5154724 | 0.70 | — | — | |
| SCHEMBL370476 | 0.69 | TDP1 (0.45) | — | |
| SCHEMBL21718532 | 0.69 | HDAC8 (0.30) | — | |
| SCHEMBL19869649 | 0.67 | TTR (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-10363248-B2 | Salts of heterocyclic modulators of HIF activity for treatment of disease | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2019-07-30 | — | — | US | disclosed |
| US-20170216271-A1 | SALTS OF HETEROCYCLIC MODULATORS OF HIF ACTIVITY FOR TREATMENT OF DISEASE | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM | 2017-08-03 | — | — | US | disclosed |