⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17903235 | 0.91 | GABBR2 (0.46) | — | |
| SCHEMBL15281117 | 0.91 | GABBR2 (0.46) | — | |
| SCHEMBL23104805 | 0.85 | — | — | |
| SCHEMBL28528160 | 0.82 | LPAR3 (0.44) | — | |
| SCHEMBL12112826 | 0.78 | TYMS (0.52) | — | |
| SCHEMBL2385908 | 0.78 | — | — | |
| SCHEMBL7648498 | 0.78 | — | — | |
| SCHEMBL13725451 | 0.77 | PPARD (0.59) | — | |
| Hydrochloric Acid SCHEMBL8730464 | 0.76 | GABBR2 (0.45) | — | |
| SCHEMBL3818168 | 0.76 | LPAR3 (0.56) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11034994-B2 | In vivo detection of phospholipase activation | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2021-06-15 | — | — | US | disclosed |
| US-9957546-B2 | Vivo detection of phospholipase activation | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2018-05-01 | — | — | US | disclosed |
| US-9957546-B2 | Vivo detection of phospholipase activation | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2018-05-01 | — | — | US | disclosed |