⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7168792 | 0.78 | — | — | |
| SCHEMBL31337705 | 0.72 | MGAM (0.48) | — | |
| SCHEMBL10337138 | 0.72 | TSHR (0.37) | — | |
| SCHEMBL3203550 | 0.71 | ALDH1A1 (0.46) | — | |
| SCHEMBL23829690 | 0.71 | — | — | |
| SCHEMBL333675 | 0.71 | — | — | |
| SCHEMBL2701192 | 0.71 | — | — | |
| SCHEMBL16436873 | 0.71 | — | — | |
| SCHEMBL9059109 | 0.69 | DGAT1 (0.34) | — | |
| SCHEMBL9796828 | 0.69 | — | — |
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-1210480-B1 | METHOD OF PRODUCING PAPER, PAPERBOARD AND CARDBOARD | BASF AG (DE) | 2003-05-14 | — | — | EP | disclosed |
| EP-1210480-A1 | METHOD OF PRODUCING PAPER, PAPERBOARD AND CARDBOARD | BASF AKTIENGESELLSCHAFT (DE) | 2002-06-05 | — | — | EP | disclosed |
| EP-1144582-A1 | WATER REPELLENT FINISHING AGENT FOR HARD SURFACES | BASF AKTIENGESELLSCHAFT (DE) | 2001-10-17 | — | — | EP | disclosed |
| WO-2001016425-A1 | METHOD OF PRODUCING PAPER, PAPERBOARD AND CARDBOARD | BASF AKTIENGESELLSCHAFT (DE) | 2001-03-08 | — | — | WO | disclosed |
| WO-2000043483-A1 | WATER REPELLENT FINISHING AGENT FOR HARD SURFACES | BASF AKTIENGESELLSCHAFT (DE) | 2000-07-27 | — | — | WO | disclosed |