⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6757841 | 0.77 | — | — | |
| SCHEMBL13854822 | 0.77 | — | — | |
| SCHEMBL17036874 | 0.73 | — | — | |
| SCHEMBL19627514 | 0.71 | FUCA1 (0.32) | — | |
| SCHEMBL18269770 | 0.71 | — | — | |
| SCHEMBL14270612 | 0.70 | — | — | |
| SCHEMBL18755313 | 0.68 | — | — | |
| SCHEMBL18755335 | 0.68 | — | — | |
| SCHEMBL19244572 | 0.68 | — | — | |
| SCHEMBL18755341 | 0.68 | — | — |
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-20170114341-A1 | POLYNUCLEOTIDE CONSTRUCTS HAVING BIOREVERSIBLE AND NON-BIOREVERSIBLE GROUPS | BRADSHAW CURT W (US) | 2017-04-27 | — | — | US | disclosed |
| US-20160257961-A1 | POLYNUCLEOTIDE CONSTRUCTS HAVING DISULFIDE GROUPS | BRADSHAW CURT W (US) | 2016-09-08 | — | — | US | disclosed |