⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2680481 | 1.00 | — | — | |
| SCHEMBL848224 | 1.00 | — | — | |
| SCHEMBL2804997 | 0.93 | — | — | |
| SCHEMBL30945869 | 0.89 | — | — | |
| SCHEMBL30540306 | 0.87 | — | — | |
| SCHEMBL7591376 | 0.85 | — | — | |
| SCHEMBL14861335 | 0.83 | — | — | |
| SCHEMBL1581276 | 0.83 | — | — | |
| SCHEMBL3384336 | 0.83 | — | — | |
| SCHEMBL7048723 | 0.83 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5998084-A | RADIATION-SENSITIVE 1,2-NAPHTHOQUINONE-2-DIAZIDE-4- OR -5-SULFONIC ACID ESTER OF A POLYCONDENSATE HAVING PHENOLIC HYDROXY GROUPS; NOVOLAK; VINYL POLYMER COMPRISING AT LEAST ONE UNIT HAVING A LATERAL HYDROXYPHENYL GROUP, CLATHRATE | AGFA-GEVAERT N.V. (BE) | 1999-12-07 | — | — | US | disclosed |
| EP-0774692-B1 | Radiation-sensitive recording material for the production of planographic printing plates | AGFA GEVAERT AG (DE) | 1999-09-29 | — | — | EP | disclosed |
| EP-0774692-A2 | Radiation-sensitive recording material for the production of planographic printing plates | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-05-21 | — | — | EP | disclosed |