⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8928446 | 0.86 | — | — | |
| SCHEMBL28288091 | 0.82 | SMN1; SMN2 (0.43) | — | |
| SCHEMBL28464414 | 0.80 | TET2 (0.30) | — | |
| SCHEMBL29093484 | 0.80 | TET2 (0.30) | — | |
| SCHEMBL27783807 | 0.79 | — | — | |
| SCHEMBL29271178 | 0.77 | TSHR (0.33) | — | |
| Hydrazinecarboxamide SCHEMBL28179813 | 0.74 | CYP1A2 (0.33) | — | |
| SCHEMBL29270320 | 0.72 | MGAM (0.31) | — | |
| SCHEMBL27703328 | 0.72 | TSHR (0.33) | — | |
| SCHEMBL13734020 | 0.71 | TSHR (0.37) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109678584-A | A kind of organic sylvite water soluble fertilizer | 广西大学 | 2019-04-26 | — | — | CN | claimed |
| CN-109776215-A | A kind of dedicated organic sylvite magnesium class fertilizer of flue-cured tobacco and preparation method thereof | 广西大学 | 2019-05-21 | — | — | CN | disclosed |
| CN-109678584-A | A kind of organic sylvite water soluble fertilizer | 广西大学 | 2019-04-26 | — | — | CN | disclosed |
| CN-109678584-A | A kind of organic sylvite water soluble fertilizer | 广西大学 | 2019-04-26 | — | — | CN | disclosed |
| CN-109650996-A | A kind of dedicated organic sylvite class fertilizer of flue-cured tobacco and preparation method thereof | 广西大学 | 2019-04-19 | — | — | CN | disclosed |
| CN-100489638-C | Preparation of organic nonlinear optical material L-malic acid derivative crystal | NANJING POLYTECHNIQUE UNIVERSI (CN) | 2009-05-20 | — | — | CN | disclosed |
| CN-1936684-A | Preparation of organic nonlinear optical material L-malic acid derivative crystal | NANJING POLYTECHNIQUE UNIV (CN) | 2007-03-28 | — | — | CN | disclosed |