⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5623137 | 0.77 | — | — | |
| SCHEMBL7055176 | 0.77 | — | — | |
| SCHEMBL11051128 | 0.74 | — | — | |
| SCHEMBL7055106 | 0.73 | — | — | |
| SCHEMBL8461741 | 0.72 | — | — | |
| SCHEMBL4166059 | 0.72 | — | — | |
| SCHEMBL11485093 | 0.71 | THRB (0.30) | — | |
| Acetonitrile SCHEMBL27527443 | 0.70 | — | — | |
| SCHEMBL9740057 | 0.70 | KCNH2 (0.33) | — | |
| SCHEMBL2575551 | 0.66 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0006152-B1 | PROCESS FOR PREPARING 2-OXIMINOPHENYLACETONITRILE | BAYER AG (DE) | 1980-11-12 | — | — | EP | claimed |
| US-4233233-A | Process for the preparation of 2-oxoiminophenylacetonitrile | BAYER AKTIENGESELLSCHAFT (DE) | 1980-11-11 | — | — | US | claimed |
| EP-0006152-A1 | Process for preparing 2-oximinophenylacetonitrile | BAYER AG (DE) | 1980-01-09 | — | — | EP | claimed |
| US-20070154945-A1 | Immobilized biomolecule and method of detecting substance capable of interacting with biomolecule | NISSHINBO INDUSTRIES, INC. (JP) | 2007-07-05 | — | — | US | disclosed |
| EP-1722228-A1 | IMMOBILIZED BIOMOLECULE AND METHOD OF DETECTING SUBSTANCE CAPABLE OF INTERACTING WITH BIOMOLECULE | Nisshinbo Industries, Inc. (JP) | 2006-11-15 | — | — | EP | disclosed |
| US-4260555-A | CONDENSING A CYANOALKYL PHENYLSULFONATE WITH OXIMINOARYLNITRILE | CIBA-GEIGY CORPORATION (US) | 1981-04-07 | — | — | US | disclosed |
| EP-0006152-B1 | PROCESS FOR PREPARING 2-OXIMINOPHENYLACETONITRILE | BAYER AG (DE) | 1980-11-12 | — | — | EP | disclosed |
| EP-0006152-B1 | PROCESS FOR PREPARING 2-OXIMINOPHENYLACETONITRILE | BAYER AG (DE) | 1980-11-12 | — | — | EP | disclosed |
| US-4233233-A | Process for the preparation of 2-oxoiminophenylacetonitrile | BAYER AKTIENGESELLSCHAFT (DE) | 1980-11-11 | — | — | US | disclosed |
| US-4233233-A | Process for the preparation of 2-oxoiminophenylacetonitrile | BAYER AKTIENGESELLSCHAFT (DE) | 1980-11-11 | — | — | US | disclosed |
| EP-0006152-A1 | Process for preparing 2-oximinophenylacetonitrile | BAYER AG (DE) | 1980-01-09 | — | — | EP | disclosed |
| EP-0006152-A1 | Process for preparing 2-oximinophenylacetonitrile | BAYER AG (DE) | 1980-01-09 | — | — | EP | disclosed |
| EP-0006152-A1 | Process for preparing 2-oximinophenylacetonitrile | BAYER AG (DE) | 1980-01-09 | — | — | EP | disclosed |