⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12384242 | 0.82 | — | — | |
| SCHEMBL9278288 | 0.76 | KCNQ2 (0.31) | — | |
| SCHEMBL27276531 | 0.75 | NPSR1 (0.40) | — | |
| SCHEMBL18202934 | 0.72 | PIK3R1 (0.31) | — | |
| SCHEMBL18609152 | 0.72 | — | — | |
| SCHEMBL12424411 | 0.72 | KCNA3 (0.43) | — | |
| SCHEMBL20803752 | 0.71 | — | — | |
| SCHEMBL24952559 | 0.71 | SIGMAR1 (0.39) | — | |
| SCHEMBL2883694 | 0.71 | NR3C1 (0.33) | — | |
| SCHEMBL12424458 | 0.70 | OPRM1 (0.38) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8461328-B2 | Tricyclic heterocyclic compounds, compositions and methods of use thereof | GENENTECH, INC. (US) | 2013-06-11 | — | — | US | disclosed |
| US-20110201593-A1 | TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF | GENENTECH, INC. (US) | 2011-08-18 | — | — | US | disclosed |