⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27923673 | 0.80 | — | — | |
| SCHEMBL3504579 | 0.76 | — | — | |
| SCHEMBL78340 | 0.76 | — | — | |
| SCHEMBL29993937 | 0.76 | — | — | |
| SCHEMBL14903392 | 0.76 | — | — | |
| SCHEMBL1490679 | 0.76 | — | — | |
| SCHEMBL7702097 | 0.76 | KDM4E (0.52) | — | |
| SCHEMBL31039494 | 0.76 | — | — | |
| SCHEMBL417976 | 0.76 | — | — | |
| SCHEMBL27650044 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-107690281-A | Cystic fibrosis transmembrane transduction modulator modulators | 弗特克斯药品有限公司 | 2018-02-13 | — | — | CN | disclosed |