⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15095831 | 0.77 | — | — | |
| SCHEMBL4357637 | 0.55 | — | — | |
| SCHEMBL7068470 | 0.53 | — | — | |
| SCHEMBL13889209 | 0.47 | MGAM (0.35) | — | |
| SCHEMBL27685562 | 0.42 | — | — | |
| SCHEMBL15390900 | 0.42 | — | — | |
| Propane SCHEMBL10555844 | 0.42 | — | — | |
| SCHEMBL179721 | 0.42 | — | — | |
| Propane SCHEMBL9551184 | 0.42 | — | — | |
| Benzene SCHEMBL286496 | 0.39 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20110207736-A1 | COMPOUNDS THAT MODULATE EGFR ACTIVITY AND METHODS FOR TREATING OR PREVENTING CONDITIONS THEREWITH | Gatekeeper Pharmaceuticals, Inc. | 2011-08-25 | — | — | US | disclosed |