⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8350972 | 0.78 | ECE1 (0.36) | — | |
| SCHEMBL7482390 | 0.76 | ECE1 (0.39) | — | |
| SCHEMBL10972602 | 0.76 | ECE1 (0.39) | — | |
| SCHEMBL8515974 | 0.73 | S1PR1 (0.39) | — | |
| SCHEMBL7775465 | 0.66 | TSHR (0.33) | — | |
| SCHEMBL3043575 | 0.64 | TSHR (0.34) | — | |
| SCHEMBL4970112 | 0.64 | TSHR (0.34) | — | |
| SCHEMBL3090641 | 0.64 | ITGB2 (0.36) | — | |
| SCHEMBL627104 | 0.64 | KMT2A (0.43) | — | |
| SCHEMBL21226 | 0.64 | KMT2A (0.43) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0832851-A1 | Biodegradable poly (amino acids), derivatized amino acid polymers and methods for making the same | Nalco Chemical Company (US) | 1998-04-01 | — | — | EP | disclosed |