⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8075285 | 0.88 | OR51E2 (0.32) | — | |
| SCHEMBL5686182 | 0.67 | — | — | |
| SCHEMBL165696 | 0.62 | — | — | |
| SCHEMBL1932418 | 0.62 | — | — | |
| SCHEMBL8208067 | 0.60 | — | — | |
| SCHEMBL22462262 | 0.59 | — | — | |
| SCHEMBL1751020 | 0.59 | — | — | |
| SCHEMBL9718502 | 0.59 | — | — | |
| SCHEMBL11848787 | 0.57 | — | — | |
| SCHEMBL2506985 | 0.57 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-3149190-B2 | — | — | 2001-03-26 | — | — | JP | claimed |
| US-6011112-A | SILYLATED ORGANONITROGEN COMPOUNDS | WACKER-CHEMIE GMBH (DE) | 2000-01-04 | — | — | US | claimed |
| EP-0852606-B1 | ORGANOPOLYSILOXANE COMPOUNDS CROSS-LINKABLE BY CLEAVING OF ALCOHOLS TO FORM ELASTOMERS | WACKER CHEMIE GMBH (DE) | 1999-04-14 | — | — | EP | claimed |
| EP-0852606-A1 | ORGANOPOLYSILOXANE COMPOUNDS CROSS-LINKABLE BY CLEAVING OF ALCOHOLS TO FORM ELASTOMERS | Wacker-Chemie GmbH (DE) | 1998-07-15 | — | — | EP | claimed |
| WO-1997012939-A1 | ORGANOPOLYSILOXANE COMPOUNDS CROSS-LINKABLE BY CLEAVING OF ALCOHOLS TO FORM ELASTOMERS | WACKER-CHEMIE GMBH (DE) | 1997-04-10 | — | — | WO | claimed |
| EP-0852606-B1 | ORGANOPOLYSILOXANE COMPOUNDS CROSS-LINKABLE BY CLEAVING OF ALCOHOLS TO FORM ELASTOMERS | WACKER CHEMIE GMBH (DE) | 1999-04-14 | — | — | EP | disclosed |
| EP-0852606-A1 | ORGANOPOLYSILOXANE COMPOUNDS CROSS-LINKABLE BY CLEAVING OF ALCOHOLS TO FORM ELASTOMERS | Wacker-Chemie GmbH (DE) | 1998-07-15 | — | — | EP | disclosed |
| WO-1997012939-A1 | ORGANOPOLYSILOXANE COMPOUNDS CROSS-LINKABLE BY CLEAVING OF ALCOHOLS TO FORM ELASTOMERS | WACKER-CHEMIE GMBH (DE) | 1997-04-10 | — | — | WO | disclosed |