⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3435579 | 0.84 | USP2 (0.30) | — | |
| SCHEMBL23214543 | 0.84 | — | — | |
| SCHEMBL1198830 | 0.73 | — | — | |
| SCHEMBL18558811 | 0.73 | — | — | |
| SCHEMBL15437081 | 0.73 | HSD17B10 (0.36) | — | |
| SCHEMBL2244526 | 0.73 | — | — | |
| SCHEMBL15349037 | 0.69 | FBP1 (0.31) | — | |
| SCHEMBL18039630 | 0.68 | NPSR1 (0.47) | — | |
| SCHEMBL22577249 | 0.67 | USP2 (0.32) | — | |
| SCHEMBL24013775 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2699617-A1 | CONJUGATED POLYMERS | Merck Patent GmbH (DE) | 2014-02-26 | — | — | EP | disclosed |
| US-20140034880-A1 | CONJUGATED POLYMERS | MERCK PATENT GMBH (DE) | 2014-02-06 | — | — | US | disclosed |
| US-20140034880-A1 | CONJUGATED POLYMERS | MERCK PATENT GMBH (DE) | 2014-02-06 | — | — | US | disclosed |
| US-20140034880-A1 | CONJUGATED POLYMERS | MERCK PATENT GMBH (DE) | 2014-02-06 | — | — | US | disclosed |
| WO-2012143081-A1 | CONJUGATED POLYMERS | MERCK PATENT GMBH (DE) | 2012-10-26 | — | — | WO | disclosed |