⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16744216 | 0.67 | — | — | |
| SCHEMBL9834398 | 0.66 | MAOA (0.50) | — | |
| SCHEMBL12424583 | 0.65 | CA1 (0.33) | — | |
| SCHEMBL17947495 | 0.64 | — | — | |
| SCHEMBL16744207 | 0.64 | CYP1A2 (0.30) | — | |
| SCHEMBL27401573 | 0.57 | KCNH2 (0.41) | — | |
| SCHEMBL371433 | 0.57 | CA1 (0.47) | — | |
| SCHEMBL20710540 | 0.57 | EPHX2 (0.47) | — | |
| SCHEMBL12410901 | 0.57 | — | — | |
| SCHEMBL7647990 | 0.56 | CYP1A2 (0.46) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9737516-B2 | Bicyclic heterocycles as bet protein inhibitors | INCYTE CORPORATION (US) | 2017-08-22 | — | — | US | disclosed |
| US-20160213654-A1 | BICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS | INCYTE CORPORATION | 2016-07-28 | — | — | US | disclosed |
| US-9315501-B2 | Bicyclic heterocycles as BET protein inhibitors | INCYTE CORPORATION (US) | 2016-04-19 | — | — | US | disclosed |
| US-20150148375-A1 | BICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS | INCYTE CORPORATION (US) | 2015-05-28 | — | — | US | disclosed |