⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2170804 | 0.76 | ALOX15 (0.31) | — | |
| SCHEMBL9938501 | 0.75 | — | — | |
| SCHEMBL851908 | 0.72 | — | — | |
| SCHEMBL850359 | 0.68 | TGFBR1 (0.35) | — | |
| SCHEMBL851353 | 0.67 | HTT (0.32) | — | |
| SCHEMBL9244219 | 0.66 | — | — | |
| SCHEMBL17672253 | 0.62 | TDP1 (0.41) | — | |
| SCHEMBL8446634 | 0.62 | CA2 (0.43) | — | |
| Chloromethane SCHEMBL18426111 | 0.61 | TDP1 (0.36) | — | |
| SCHEMBL691968 | 0.61 | — | — |
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-2432808-A1 | ACTINICALLY-CROSSLINKABLE SILOXANE-CONTAINING COPOLYMERS | Novartis AG (CH) | 2012-03-28 | — | — | EP | claimed |
| WO-2010133680-A1 | ACTINICALLY-CROSSLINKABLE SILOXANE-CONTAINING COPOLYMERS | NOVARTIS AG (CH) | 2010-11-25 | — | — | WO | claimed |