⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL525088 | 0.82 | — | — | |
| SCHEMBL81709 | 0.82 | — | — | |
| SCHEMBL20162406 | 0.73 | — | — | |
| SCHEMBL4015991 | 0.73 | — | — | |
| SCHEMBL81743 | 0.68 | — | — | |
| SCHEMBL9112927 | 0.67 | — | — | |
| SCHEMBL3341050 | 0.67 | TSHR (0.33) | — | |
| SCHEMBL159337 | 0.67 | — | — | |
| SCHEMBL15902363 | 0.66 | — | — | |
| SCHEMBL4431966 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3172279-B1 | ORGANOPOLYSILOXANE COMPOSITIONS WHICH CAN BE CROSSLINKED BY MEANS OF A CONDENSATION REACTION | WACKER CHEMIE AG (DE) | 2018-05-23 | — | — | EP | disclosed |
| EP-3172279-A1 | ORGANOPOLYSILOXANE COMPOSITIONS WHICH CAN BE CROSSLINKED BY MEANS OF A CONDENSATION REACTION | Wacker Chemie AG (DE) | 2017-05-31 | — | — | EP | disclosed |
| WO-2016120106-A1 | ORGANOPOLYSILOXANE COMPOSITIONS WHICH CAN BE CROSSLINKED BY MEANS OF A CONDENSATION REACTION | WACKER CHEMIE AG (DE) | 2016-08-04 | — | — | WO | disclosed |