⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9763334 | 0.70 | — | — | |
| SCHEMBL3788538 | 0.69 | CYP2D6 (0.35) | — | |
| SCHEMBL6036749 | 0.63 | — | — | |
| SCHEMBL1630402 | 0.59 | ALDH1A1 (0.35) | — | |
| SCHEMBL9510919 | 0.59 | ALDH1A1 (0.35) | — | |
| SCHEMBL440679 | 0.57 | ALDH1A1 (0.33) | — | |
| SCHEMBL8766278 | 0.57 | — | — | |
| SCHEMBL20677238 | 0.57 | — | — | |
| SCHEMBL643574 | 0.57 | CYP2D6 (0.41) | — | |
| SCHEMBL3833786 | 0.57 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3143015-A1 | HETEROARYL COMPOUNDS FOR KINASE INHIBITION | ARIAD Pharmaceuticals, Inc. (US) | 2017-03-22 | — | — | EP | claimed |
| WO-2015175632-A1 | HETEROARYL COMPOUNDS FOR KINASE INHIBITION | ARIAD PHARMACEUTICALS, INC. (US) | 2015-11-19 | — | — | WO | claimed |
| US-20130274284-A1 | PREPARATION OF PRASUGREL HYDROCHLORIDE | DR. REDDY'S LABORATORIES, INC. (US) | 2013-10-17 | — | — | US | disclosed |
| EP-2601200-A2 | PREPARATION OF PRASUGREL HYDROCHLORIDE | Dr. Reddy's Laboratories Ltd. (IN) | 2013-06-12 | — | — | EP | disclosed |
| WO-2012018791-A2 | PREPARATION OF PRASUGREL HYDROCHLORIDE | DR. REDDY'S LABORATORIES LTD. (IN) | 2012-02-09 | — | — | WO | disclosed |