⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5268462 | 0.85 | GABRA5 (0.42) | — | |
| SCHEMBL3448685 | 0.84 | L3MBTL1 (0.33) | — | |
| SCHEMBL17395272 | 0.80 | — | — | |
| SCHEMBL2721040 | 0.78 | — | — | |
| SCHEMBL992229 | 0.78 | — | — | |
| SCHEMBL12987123 | 0.78 | — | — | |
| SCHEMBL697321 | 0.78 | — | — | |
| Lithium SCHEMBL31426996 | 0.76 | ANPEP (0.36) | — | |
| SCHEMBL10626327 | 0.76 | LMNA (0.37) | — | |
| SCHEMBL12224105 | 0.75 | PPM1B (0.43) | — |
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-112624921-A | Synthesis method and application of 1-hydroxymethyl cyclopropyl acetic acid | 牡丹江恒远药业股份有限公司 | 2021-04-09 | — | — | CN | claimed |
| CN-111072475-A | Synthesis method and application of 1-hydroxymethyl cyclopropyl acetic acid | 牡丹江恒远药业股份有限公司 | 2020-04-28 | — | — | CN | claimed |
| CN-112624921-A | Synthesis method and application of 1-hydroxymethyl cyclopropyl acetic acid | 牡丹江恒远药业股份有限公司 | 2021-04-09 | — | — | CN | disclosed |
| CN-112624921-A | Synthesis method and application of 1-hydroxymethyl cyclopropyl acetic acid | 牡丹江恒远药业股份有限公司 | 2021-04-09 | — | — | CN | disclosed |
| CN-111072475-A | Synthesis method and application of 1-hydroxymethyl cyclopropyl acetic acid | 牡丹江恒远药业股份有限公司 | 2020-04-28 | — | — | CN | disclosed |
| CN-111072475-A | Synthesis method and application of 1-hydroxymethyl cyclopropyl acetic acid | 牡丹江恒远药业股份有限公司 | 2020-04-28 | — | — | CN | disclosed |
| CN-105541786-B | A kind of Montelukast side-chain intermediate and preparation method thereof | 鲁南贝特制药有限公司 | 2017-08-08 | — | — | CN | disclosed |