⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14220945 | 0.72 | — | — | |
| SCHEMBL10715517 | 0.68 | — | — | |
| SCHEMBL12843937 | 0.68 | — | — | |
| SCHEMBL14000739 | 0.67 | CRHBP (0.34) | — | |
| SCHEMBL25099413 | 0.54 | — | — | |
| SCHEMBL3734453 | 0.54 | — | — | |
| SCHEMBL12963954 | 0.53 | — | — | |
| SCHEMBL14520166 | 0.52 | ALDH1A1 (0.46) | — | |
| SCHEMBL20702295 | 0.51 | — | — | |
| SCHEMBL7929024 | 0.50 | — | — |
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-7459450-B2 | Neuropeptide receptor modulators | SCHERING CORPORATION (US) | 2008-12-02 | — | — | US | disclosed |