⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25192445 | 0.98 | — | — | |
| SCHEMBL25742594 | 0.98 | — | — | |
| SCHEMBL7916781 | 0.85 | — | — | |
| SCHEMBL9981915 | 0.68 | MAPT (0.39) | — | |
| SCHEMBL5254875 | 0.67 | — | — | |
| SCHEMBL2691519 | 0.67 | — | — | |
| SCHEMBL27947723 | 0.66 | — | — | |
| SCHEMBL11832757 | 0.65 | — | — | |
| SCHEMBL823033 | 0.65 | — | — | |
| SCHEMBL19784615 | 0.65 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103827105-B | Substituted heterocyclic amine compound as cholesterol ester transfer protein (CETP) inhibitor | 雷迪博士实验室有限公司 | 2016-08-17 | — | — | CN | disclosed |
| US-9351969-B2 | Substituted heterocyclic amine compounds as cholesteryl ester-transfer protein (CETP) inhibitors | DR. REDDY'S LABORATORIES LTD. (IN) | 2016-05-31 | — | — | US | disclosed |
| US-20160045488-A1 | SUBSTITUTED HETEROCYCLIC AMINE COMPOUNDS AS CHOLESTERYL ESTER-TRANSFER PROTEIN (CETP) INHIBITORS | DR. REDDY'S LABORATORIES LTD. (IN) | 2016-02-18 | — | — | US | disclosed |
| US-9199967-B2 | Substituted heterocyclic amine compounds as cholestryl ester-transfer protein (CETP) inhibitors | DR. REDDY'S LABORATORIES LTD. (IN) | 2015-12-01 | — | — | US | disclosed |
| US-20140256724-A1 | SUBSTITUTED HETEROCYCLIC AMINE COMPOUNDS AS CHOLESTRYL ESTER-TRANSFER PROTEIN (CETP) INHIBITORS | DR. REDDY'S LABORATORIES LTD. (IN) | 2014-09-11 | — | — | US | disclosed |
| EP-2744803-A2 | SUBSTITUTED HETEROCYCLIC AMINE COMPOUNDS AS CHOLESTRYL ESTER-TRANSFER PROTEIN (CETP) INHIBITORS | Dr. Reddy's Laboratories Ltd. (IN) | 2014-06-25 | — | — | EP | disclosed |
| CN-103827105-A | Substituted heterocyclic amine compounds as cholestryl ester-transfer protein (CETP) inhibitors | REDDYS LAB LTD DR | 2014-05-28 | — | — | CN | disclosed |
| WO-2013024358-A2 | SUBSTITUTED HETEROCYCLIC AMINE COMPOUNDS AS CHOLESTRYL ESTER-TRANSFER PROTEIN (CETP) INHIBITORS | DR. REDDY'S LABORATORIES LTD. (IN) | 2013-02-21 | — | — | WO | disclosed |