⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12835437 | 0.76 | — | — | |
| SCHEMBL13745879 | 0.70 | — | — | |
| SCHEMBL10395750 | 0.70 | — | — | |
| SCHEMBL438330 | 0.67 | — | — | |
| SCHEMBL26981421 | 0.67 | — | — | |
| SCHEMBL244295 | 0.67 | — | — | |
| SCHEMBL21557029 | 0.67 | — | — | |
| SCHEMBL21401881 | 0.67 | — | — | |
| SCHEMBL170626 | 0.67 | — | — | |
| SCHEMBL27720020 | 0.65 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019177375-A1 | 2, 4, 5-SUBSTITUTED PYRIMIDINE DERIVATIVES, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER COMPRISING SAME AS ACTIVE INGREDIENT | 포로노이바이오 주식회사 | 2019-09-19 | — | — | WO | claimed |
| CN-105315528-A | Reaction type non-asphalt base waterproof composition | LU GUICAI | 2016-02-10 | — | — | CN | claimed |
| CN-110407852-A | Double aromatic ring derivative egf inhibitors of a kind of Thienopyrimidine and preparation method thereof and purposes | YAOYA TECH SHANGHAI CO LTD | 2019-11-05 | — | — | CN | disclosed |
| CN-110396095-A | Double aromatic ring derivative egf inhibitors of a kind of Furanopyrimidines and preparation method thereof and purposes | YAOYA TECH SHANGHAI CO LTD | 2019-11-01 | — | — | CN | disclosed |
| CN-105315528-A | Reaction type non-asphalt base waterproof composition | LU GUICAI | 2016-02-10 | — | — | CN | disclosed |
| US-5324776-A | Process for the preparation of polymers containing amino groups | WOLFF WALSRODE AG (DE) | 1994-06-28 | — | — | US | disclosed |