⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3978351 | 0.67 | — | — | |
| SCHEMBL2223105 | 0.64 | — | — | |
| SCHEMBL3975532 | 0.64 | — | — | |
| SCHEMBL42968 | 0.62 | GRIN2D (0.33) | — | |
| SCHEMBL5716591 | 0.61 | ALDH1A1 (0.34) | — | |
| SCHEMBL13789685 | 0.59 | — | — | |
| SCHEMBL5857929 | 0.59 | — | — | |
| SCHEMBL21328572 | 0.57 | — | — | |
| SCHEMBL10954874 | 0.57 | GRIN2D (0.31) | — | |
| Hydrochloric Acid SCHEMBL4178849 | 0.57 | GRIN2D (0.31) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1114054-A1 | METHOD FOR PRODUCING MONO- OR DI-ORGANO-BORANES | Basell Polypropylen GmbH (DE) | 2001-07-11 | — | — | EP | claimed |
| WO-2000017208-A1 | METHOD FOR PRODUCING MONO- OR DI-ORGANO-BORANES | BASELL POLYOLEFINE GMBH (DE) | 2000-03-30 | — | — | WO | claimed |
| EP-1114054-A1 | METHOD FOR PRODUCING MONO- OR DI-ORGANO-BORANES | Basell Polypropylen GmbH (DE) | 2001-07-11 | — | — | EP | disclosed |
| WO-2000017208-A1 | METHOD FOR PRODUCING MONO- OR DI-ORGANO-BORANES | BASELL POLYOLEFINE GMBH (DE) | 2000-03-30 | — | — | WO | disclosed |