⚠ 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 | |
|---|---|---|---|---|
| Butanol SCHEMBL28361508 | 0.72 | TSHR (0.53) | — | |
| SCHEMBL1110692 | 0.70 | — | — | |
| SCHEMBL19834916 | 0.70 | CYP1A2 (0.37) | — | |
| Hexylene Glycol SCHEMBL335683 | 0.69 | — | — | |
| Hexylene Glycol SCHEMBL123432 | 0.69 | — | — | |
| SCHEMBL28964362 | 0.69 | — | — | |
| Hexylene Glycol SCHEMBL6869929 | 0.69 | MAPK1 (0.39) | — | |
| SCHEMBL16074731 | 0.69 | MAPK1 (0.39) | — | |
| Hexylene Glycol SCHEMBL19379 | 0.69 | — | — | |
| Hexylene Glycol SCHEMBL3391421 | 0.69 | MAPK1 (0.32) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7960516-B2 | Solid forms of anti-EGFR antibodies | MERCK PATENT GMBH (DE) | 2011-06-14 | — | — | US | disclosed |
| EP-1974723-A2 | Secure forms of anti-EGFR antibodies | Merck Patent GmbH (DE) | 2008-10-01 | — | — | EP | disclosed |
| US-20070122411-A1 | Solid forms of anti-egfr antibodies | MERCK PATENT GMBH (DE) | 2007-05-31 | — | — | US | disclosed |
| EP-1686961-A1 | SOLID FORMS OF ANTI-EGFR-ANTIBODIES | MERCK PATENT GmbH (DE) | 2006-08-09 | — | — | EP | disclosed |
| WO-2005051355-A1 | SOLID FORMS OF ANTI-EGFR-ANTIBODIES | MERCK PATENT GMBH (DE) | 2005-06-09 | — | — | WO | disclosed |