⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1049538 | 0.79 | — | — | |
| SCHEMBL27882777 | 0.78 | — | — | |
| SCHEMBL27691375 | 0.74 | — | — | |
| SCHEMBL1569446 | 0.74 | — | — | |
| SCHEMBL10871545 | 0.74 | ALDH1A1 (0.33) | — | |
| SCHEMBL1722804 | 0.74 | — | — | |
| SCHEMBL113676 | 0.73 | — | — | |
| SCHEMBL3394431 | 0.72 | NAAA (0.43) | — | |
| SCHEMBL9296094 | 0.72 | — | — | |
| SCHEMBL29406069 | 0.71 | NAAA (0.47) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-103217493-A | Method for measuring cabazitaxel related substances by using HPLC (High Performance Liquid Chromatography) method | SHINEWAY PHARMACEUTICAL GROUP CO LTD | 2013-07-24 | — | — | CN | disclosed |
| US-4914129-A | Antihypertensive 5-amino-4-hydroxyvaleryl derivatives substituted by sulphur-containing groups | CIBA-GEIGY CORPORATION (US) | 1990-04-03 | — | — | US | disclosed |
| US-4889869-A | ANTIALDOSTERONISM AGENTS | CIBA-GEIGY CORPORATION (US) | 1989-12-26 | — | — | US | disclosed |
| US-4758584-A | Antihypertensive 5-amino-4-hydroxyvaleryl derivatives substituted by sulphur-containing groups | CIBA-GEIGY CORPORATION (US) | 1988-07-19 | — | — | US | disclosed |