⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL127444 | 0.74 | — | — | |
| SCHEMBL11512242 | 0.67 | — | — | |
| SCHEMBL13492116 | 0.67 | — | — | |
| SCHEMBL3857042 | 0.64 | — | — | |
| Benzene SCHEMBL28180746 | 0.64 | CA1 (0.35) | — | |
| Boric Acid SCHEMBL7856182 | 0.63 | LMNA (0.44) | — | |
| Boric Acid SCHEMBL6023479 | 0.63 | — | — | |
| Butadiene SCHEMBL28269415 | 0.63 | — | — | |
| Boric Acid SCHEMBL21616734 | 0.60 | — | — | |
| Boric Acid SCHEMBL28458009 | 0.60 | TSHR (0.40) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007118474-A2 | METHOD FOR THE PRODUCTION OF HYDROGEN-RICH SILANES, AND NOVEL CHEMICAL COMPOUNDS | TECHNISCHE UNIVERSITÄT BERGAKADEMIE FREIBERG (DE) | 2007-10-25 | — | — | WO | claimed |
| WO-2007118474-A2 | METHOD FOR THE PRODUCTION OF HYDROGEN-RICH SILANES, AND NOVEL CHEMICAL COMPOUNDS | TECHNISCHE UNIVERSITÄT BERGAKADEMIE FREIBERG (DE) | 2007-10-25 | — | — | WO | disclosed |
| US-6417302-B1 | REACTION PRODUCT OF DI(PENTAFLUOROPHENYL) BORINIC ACID AND ORGANOALUMINUM COMPOUND; OLEFIN POLYMERIZATION COORDINATION CATALYSTS | BASELL POLYOLEFINE GMBH (DE) | 2002-07-09 | — | — | US | disclosed |