⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15059666 | 0.90 | JAK2 (0.45) | — | |
| SCHEMBL16204330 | 0.85 | — | — | |
| SCHEMBL15059045 | 0.80 | — | — | |
| SCHEMBL15058707 | 0.78 | PIK3CA (0.56) | — | |
| SCHEMBL15058300 | 0.78 | ALOX15 (0.49) | — | |
| SCHEMBL15058069 | 0.77 | — | — | |
| SCHEMBL24703391 | 0.76 | PIK3CA (0.54) | — | |
| SCHEMBL15058827 | 0.75 | KMT2A (0.56) | — | |
| SCHEMBL2551820 | 0.75 | ABL1 (0.48) | — | |
| SCHEMBL1553602 | 0.74 | NPC1 (0.53) | — |
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-9060515-B2 | Heterocyclic urea compounds | BIOTA EUROPE LTD. (GB) | 2015-06-23 | — | — | US | disclosed |
| US-20140323486-A1 | HETEROCYCLIC UREA COMPOUNDS | SPERO GYRASE, INC. | 2014-10-30 | — | — | US | disclosed |