⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2493186 | 0.77 | — | — | |
| SCHEMBL8649792 | 0.75 | — | — | |
| SCHEMBL12474249 | 0.74 | — | — | |
| SCHEMBL14874308 | 0.72 | SIGMAR1 (0.30) | — | |
| SCHEMBL11519789 | 0.71 | CYP1A2 (0.30) | — | |
| SCHEMBL8577287 | 0.71 | CYP1A2 (0.30) | — | |
| SCHEMBL9073132 | 0.71 | CYP1A2 (0.30) | — | |
| SCHEMBL8577284 | 0.71 | CYP1A2 (0.30) | — | |
| SCHEMBL13892957 | 0.71 | EPHX1 (0.35) | — | |
| SCHEMBL11519786 | 0.71 | CYP1A2 (0.30) | — |
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-5051224-A | Crosslinked vinylorganosiloxane for composites | DOW CORNING CORPORATION (US) | 1991-09-24 | — | — | US | disclosed |
| US-4973642-A | CROSSLINKED POLYSILOXANES | DOW CORNING CORPORATION (US) | 1990-11-27 | — | — | US | disclosed |
| EP-0328895-A2 | High temperature crumb silicone rubber for use in composite manufacture | DOW CORNING CORPORATION (US) | 1989-08-23 | — | — | EP | disclosed |
| US-4076648-A | LIPOPHILIC NONIONIC SURFACTANT DISPERSED IN A NON-EMULSIFIED POLYSILOXANE | UNION CARBIDE CORPORATION (US) | 1978-02-28 | — | — | US | disclosed |