⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5038504 | 0.63 | — | — | |
| SCHEMBL10694423 | 0.61 | LMNA (0.37) | — | |
| SCHEMBL11061486 | 0.61 | LMNA (0.55) | — | |
| SCHEMBL8342071 | 0.60 | SMN1; SMN2 (0.42) | — | |
| SCHEMBL225395 | 0.60 | KMT2A (0.31) | — | |
| SCHEMBL14350048 | 0.56 | — | — | |
| SCHEMBL11347011 | 0.52 | — | — | |
| Ethylene Glycol SCHEMBL27897184 | 0.51 | — | — | |
| SCHEMBL38886 | 0.43 | — | — | |
| SCHEMBL27737411 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7008990-B2 | Use of polymeric reaction product | BASF AKTIENGESELLSCHAFT (DE) | 2006-03-07 | — | — | US | disclosed |
| US-20030170306-A1 | Use of polymeric reaction product | BASF AKTIENGESELLSCHAFT (DE) | 2003-09-11 | — | — | US | disclosed |