⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15160520 | 0.84 | — | — | |
| SCHEMBL3013396 | 0.78 | TSHR (0.30) | — | |
| SCHEMBL19068934 | 0.77 | — | — | |
| SCHEMBL8215882 | 0.76 | — | — | |
| SCHEMBL8217378 | 0.72 | — | — | |
| SCHEMBL2771614 | 0.72 | — | — | |
| SCHEMBL18856300 | 0.72 | TSHR (0.30) | — | |
| SCHEMBL7744145 | 0.71 | LMNA (0.38) | — | |
| SCHEMBL8220280 | 0.71 | — | — | |
| SCHEMBL8219254 | 0.70 | — | — |
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-10618902-B2 | Substituted pyrido[2,3-d]pyrimidines as inhibitors of protein kinases | CELGENE CAR LLC (BM) | 2020-04-14 | — | — | US | disclosed |
| US-20190218220-A1 | HETEROARYL COMPOUNDS AND USES THEREOF | BRISTOL-MYERS SQUIBB COMPANY | 2019-07-18 | — | — | US | disclosed |