⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13811599 | 0.65 | — | — | |
| SCHEMBL27867560 | 0.65 | — | — | |
| SCHEMBL1576158 | 0.62 | — | — | |
| SCHEMBL11575185 | 0.60 | — | — | |
| SCHEMBL9422395 | 0.59 | — | — | |
| SCHEMBL12801948 | 0.59 | — | — | |
| SCHEMBL13976324 | 0.59 | — | — | |
| SCHEMBL2618034 | 0.57 | — | — | |
| SCHEMBL1028584 | 0.56 | — | — | |
| SCHEMBL535025 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20180334730-A1 | METHODS AND KITS FOR DETERMINING DNA REPAIR CAPACITY | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2018-11-22 | — | — | US | disclosed |
| US-9938587-B2 | Methods and kits for determining DNA repair capacity | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2018-04-10 | — | — | US | disclosed |
| US-20140227701-A1 | METHODS AND KITS FOR DETERMINING DNA REPAIR CAPACITY | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2014-08-14 | — | — | US | disclosed |
| WO-2013043936-A1 | METHODS AND KITS FOR DETERMINING DNA REPAIR CAPACITY | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2013-03-28 | — | — | WO | disclosed |