⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31046573 | 0.84 | PRKCA (0.42) | — | |
| SCHEMBL8870930 | 0.81 | POLB (0.33) | — | |
| SCHEMBL57533 | 0.80 | TSHR (0.38) | — | |
| SCHEMBL9789945 | 0.79 | — | — | |
| SCHEMBL15429216 | 0.78 | PRKCA (0.40) | — | |
| SCHEMBL63687 | 0.78 | — | — | |
| SCHEMBL2568905 | 0.78 | PRKCA (0.40) | — | |
| Ethylene Glycol SCHEMBL3017943 | 0.77 | CYP4F2 (0.40) | — | |
| Ethylene SCHEMBL2522734 | 0.77 | TSHR (0.40) | — | |
| SCHEMBL3005967 | 0.77 | ALDH1A1 (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009054620-A2 | ALKALI-SOLUBLE RESIN AND NEGATIVE-TYPE PHOTOSENSITIVE RESIN COMPOSITION COMPRISING THE SAME | LG CHEM. LTD. (KR) | 2009-04-30 | — | — | WO | claimed |