⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6066074 | 0.71 | RNASE1 (0.43) | — | |
| SCHEMBL6066038 | 0.69 | RNASE1 (0.42) | — | |
| SCHEMBL15145099 | 0.51 | — | — | |
| SCHEMBL27497606 | 0.49 | ABL1 (0.37) | — | |
| SCHEMBL3755179 | 0.47 | — | — | |
| SCHEMBL2384197 | 0.47 | — | — | |
| SCHEMBL1534195 | 0.45 | CYP19A1 (0.32) | — | |
| SCHEMBL11310473 | 0.44 | CES1 (0.40) | — | |
| SCHEMBL28672963 | 0.44 | KCNN4 (0.46) | — | |
| SCHEMBL23405870 | 0.44 | KIF11 (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5700642-A | HYBRIDIZING PRIMER WITH COMPLEMENTARY TARGET NUCLEIC ACID, ENZYMATICALLY EXTENDING PRIMER TO GENERATE POLYNUCLEOTIDE MIXTURE, IMMOBILIZATION, CLEAVING TO RELEASE EXTENSION SEGMENT AND MEASUREMENT BY MASS SPECTROMETRY | SRI INTERNATIONAL (US) | 1997-12-23 | — | — | US | disclosed |