⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL188015 | 0.82 | — | — | |
| SCHEMBL8972606 | 0.78 | — | — | |
| SCHEMBL4401666 | 0.75 | TSHR (0.30) | — | |
| SCHEMBL6341943 | 0.75 | LMNA (0.31) | — | |
| SCHEMBL12920755 | 0.74 | — | — | |
| SCHEMBL16286004 | 0.72 | LMNA (0.32) | — | |
| SCHEMBL214951 | 0.71 | — | — | |
| SCHEMBL16062999 | 0.69 | LMNA (0.33) | — | |
| SCHEMBL25352246 | 0.67 | — | — | |
| SCHEMBL8972561 | 0.67 | — | — |
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-0545409-B1 | Liquid crystals with end groups containing more than one silane group | CONSORTIUM ELEKTROCHEM IND (DE) | 1996-03-06 | — | — | EP | disclosed |
| US-5399290-A | Liquid crystals with (polysila) alkyl wing groups | CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) | 1995-03-21 | — | — | US | disclosed |
| EP-0545409-A1 | Liquid crystals with end groups containing more than one silane group | Consortium für elektrochemische Industrie GmbH (DE) | 1993-06-09 | — | — | EP | disclosed |