⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5046551 | 0.77 | ABCB1 (0.38) | — | |
| SCHEMBL19326404 | 0.77 | TSHR (0.38) | — | |
| SCHEMBL5046571 | 0.77 | ABCB1 (0.38) | — | |
| SCHEMBL4158985 | 0.77 | LMNA (0.40) | — | |
| SCHEMBL18756469 | 0.77 | LMNA (0.40) | — | |
| SCHEMBL25803334 | 0.77 | DNM1 (0.33) | — | |
| SCHEMBL5041947 | 0.77 | ABCB1 (0.38) | — | |
| SCHEMBL11136 | 0.76 | — | — | |
| SCHEMBL20243270 | 0.75 | — | — | |
| SCHEMBL24252609 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002092578-A1 | QUINAZOLINE DERIVATIVES | ASTRAZENECA AB (SE) | 2002-11-21 | — | — | WO | claimed |
| WO-2002092577-A1 | QUINAZOLINE DERIVATIVES | ASTRAZENECA AB (SE) | 2002-11-21 | — | — | WO | claimed |
| WO-2002092578-A1 | QUINAZOLINE DERIVATIVES | ASTRAZENECA AB (SE) | 2002-11-21 | — | — | WO | disclosed |
| WO-2002092577-A1 | QUINAZOLINE DERIVATIVES | ASTRAZENECA AB (SE) | 2002-11-21 | — | — | WO | disclosed |