⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3699242 | 0.78 | — | — | |
| SCHEMBL477575 | 0.74 | ENPEP (0.32) | — | |
| SCHEMBL122897 | 0.73 | — | — | |
| SCHEMBL7537359 | 0.72 | — | — | |
| SCHEMBL5425296 | 0.72 | — | — | |
| SCHEMBL3103583 | 0.72 | — | — | |
| SCHEMBL4087471 | 0.71 | — | — | |
| SCHEMBL8852351 | 0.71 | ALDH1A1 (0.32) | — | |
| Propane SCHEMBL8411429 | 0.71 | TSHR (0.30) | — | |
| SCHEMBL5404685 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8372514-B2 | Moisture-curing composition comprising at least two polymers having silane groups | SIKA TECHNOLOGY AG (CH) | 2013-02-12 | — | — | US | disclosed |
| US-20100247929-A1 | MOISTURE-CURING COMPOSITION COMPRISING AT LEAST TWO POLYMERS HAVING SILANE GROUPS | SIKA TECHNOLOGY AG (CH) | 2010-09-30 | — | — | US | disclosed |
| US-3997581-A | BONDING AGENTS IN SULFUR VULCANIZABLE RUBBERS | DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DT) | 1976-12-14 | — | — | US | disclosed |