⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3288518 | 0.82 | — | — | |
| SCHEMBL107926 | 0.78 | — | — | |
| SCHEMBL22970 | 0.78 | — | — | |
| SCHEMBL11231470 | 0.76 | — | — | |
| SCHEMBL9723984 | 0.76 | — | — | |
| Bromoethane SCHEMBL11221113 | 0.76 | — | — | |
| Hexane SCHEMBL27956863 | 0.73 | TSHR (0.54) | — | |
| Hydrochloric Acid SCHEMBL25372393 | 0.72 | — | — | |
| SCHEMBL11694327 | 0.72 | — | — | |
| SCHEMBL389591 | 0.72 | — | — |
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-0104236-B1 | HYDROCARBON SOLVENT SOLUTIONS OF COMPLEXES OF (A) N-BUTYLLITHIUM, (B) SEC-BUTYLLITHIUM, AND (C) ISOPROPYLLITHIUM, WITH ETHYLLITHIUM | LITHIUM CORPORATION OF AMERICA (US) | 1986-10-08 | — | — | EP | disclosed |
| EP-0104236-A4 | HYDROCARBON SOLVENT SOLUTIONS OF COMPLEXES OF (a) n-BUTYLLITHIUM, (b) SEC-BUTYLLITHIUM, AND (c) ISOPROPYLLITHIUM, WITH ETHYLLITHIUM. | LITHIUM CORP (US) | 1984-07-26 | — | — | EP | disclosed |
| EP-0104236-A1 | HYDROCARBON SOLVENT SOLUTIONS OF COMPLEXES OF (a) n-BUTYLLITHIUM, (b) SEC-BUTYLLITHIUM, AND (c) ISOPROPYLLITHIUM, WITH ETHYLLITHIUM. | LITHIUM CORP (US) | 1984-04-04 | — | — | EP | disclosed |
| US-4429054-A | POLYMERIZATION CATALYSTS, METALLIZING AGENTS | LITHIUM CORPORATION OF AMERICA (US) | 1984-01-31 | — | — | US | disclosed |
| WO-1983003251-A1 | HYDROCARBON SOLVENT SOLUTIONS OF COMPLEXES OF (a) n-BUTYLLITHIUM, (b) SEC-BUTYLLITHIUM, AND (c) ISOPROPYLLITHIUM, WITH ETHYLLITHIUM | LITHIUM CORP (US) | 1983-09-29 | — | — | WO | disclosed |