⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3846225 | 0.79 | — | — | |
| SCHEMBL5010020 | 0.78 | KDM4E (0.31) | — | |
| SCHEMBL9035272 | 0.67 | — | — | |
| SCHEMBL28109731 | 0.65 | — | — | |
| SCHEMBL2957240 | 0.61 | — | — | |
| Hydrochloric Acid SCHEMBL28842862 | 0.59 | — | — | |
| SCHEMBL208969 | 0.58 | — | — | |
| SCHEMBL29707140 | 0.58 | — | — | |
| SCHEMBL7745 | 0.58 | — | — | |
| Chloroacetone SCHEMBL19827 | 0.58 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1934204-A2 | PROCESS FOR PREPARATION OF APREPITANT | RANBAXY LABORATORIES, LTD. (IN) | 2008-06-25 | — | — | EP | claimed |
| WO-2007039883-A2 | PROCESS FOR PREPARATION OF APREPITANT | RANBAXY LABORATORIES LIMITED (IN) | 2007-04-12 | — | — | WO | claimed |
| EP-2057151-A2 | PROCESS FOR PURIFICATION OF APREPITANT | Hetero Drugs Limited (IN) | 2009-05-13 | — | — | EP | disclosed |
| EP-1934204-A2 | PROCESS FOR PREPARATION OF APREPITANT | RANBAXY LABORATORIES, LTD. (IN) | 2008-06-25 | — | — | EP | disclosed |
| WO-2008026216-A2 | PROCESS FOR PURIFICATION OF APREPITANT | HETERO DRUGS LIMITED (IN) | 2008-03-06 | — | — | WO | disclosed |
| WO-2007039883-A2 | PROCESS FOR PREPARATION OF APREPITANT | RANBAXY LABORATORIES LIMITED (IN) | 2007-04-12 | — | — | WO | disclosed |