⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL935643 | 0.94 | — | — | |
| SCHEMBL20475 | 0.94 | — | — | |
| SCHEMBL1331313 | 0.94 | — | — | |
| SCHEMBL1276473 | 0.94 | TSHR (0.36) | — | |
| Ammonia Solution, Strong SCHEMBL3896205 | 0.88 | — | — | |
| Water SCHEMBL10594279 | 0.88 | TSHR (0.33) | — | |
| Ammonia Solution, Strong SCHEMBL10394131 | 0.88 | — | — | |
| SCHEMBL8908192 | 0.88 | — | — | |
| Hydrogen Sulfide SCHEMBL15659292 | 0.88 | — | — | |
| Water SCHEMBL21954509 | 0.88 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-102757458-B | Method and device for preparing tetramethyldihydrodisiloxane | JIAXING UNITED CHEMICAL CO LTD | 2015-04-29 | — | — | CN | disclosed |
| US-5923044-A | Lithium dialkylamide and lithium alkylenecycloimide formulations and methods of preparation | FMC CORPORATION (US) | 1999-07-13 | — | — | US | disclosed |
| WO-1997021714-A1 | LITHIUM DIALKYLAMIDE AND LITHIUM ALKYLENECYCLOIMIDE FORMULATIONS AND METHODS OF PREPARATION | FMC CORPORATION (US) | 1997-06-19 | — | — | WO | disclosed |