⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14857231 | 0.92 | — | — | |
| SCHEMBL11501664 | 0.84 | — | — | |
| SCHEMBL9112213 | 0.72 | — | — | |
| SCHEMBL3430672 | 0.72 | — | — | |
| SCHEMBL6147289 | 0.69 | — | — | |
| SCHEMBL28136767 | 0.69 | — | — | |
| SCHEMBL6147291 | 0.69 | — | — | |
| SCHEMBL23540 | 0.69 | — | — | |
| SCHEMBL8897524 | 0.67 | CA1 (0.32) | — | |
| Ethylene SCHEMBL7511378 | 0.67 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013175281-A1 | USE OF SUBSTITUTED 2-PHENYL-3H-QUINAZOLIN-4-ONES AND ANALOGS FOR INHIBITING BROMODOMAIN AND EXTRA TERMINAL DOMAIN (BET) PROTEINS | RVX THERAPEUTICS INC. (CA) | 2013-11-28 | — | — | WO | disclosed |