⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8749412 | 1.00 | — | — | |
| SCHEMBL8749656 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL4662075 | 0.97 | IDO1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL4662080 | 0.97 | IDO1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL8749706 | 0.97 | IDO1 (0.33) | — | |
| SCHEMBL669588 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL1500025 | 0.82 | — | — | |
| SCHEMBL2014051 | 0.76 | — | — | |
| SCHEMBL813392 | 0.76 | — | — | |
| SCHEMBL14657823 | 0.76 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0644872-B1 | ORNITHINE DECARBOXYLASE INHIBITING CYCLIC AMINOOXY COMPOUNDS | CIBA GEIGY AG (CH) | 1997-03-19 | — | — | EP | claimed |
| US-5516806-A | ANTITUMOR | CIBA-GEIGY CORPORATION (US) | 1996-05-14 | — | — | US | claimed |
| EP-0644872-A1 | ORNITHINE DECARBOXYLASE INHIBITING CYCLIC AMINOOXY COMPOUNDS. | CIBA GEIGY AG (CH) | 1995-03-29 | — | — | EP | claimed |
| WO-1994024093-A1 | ORNITHINE DECARBOXYLASE INHIBITING CYCLIC AMINOOXY COMPOUNDS | CIBA-GEIGY AG (CH) | 1994-10-27 | — | — | WO | claimed |
| EP-1609616-B1 | REVERSIBLE THERMAL RECORDING MEDIUM | RICOH CO LTD (JP) | 2014-12-03 | — | — | EP | disclosed |
| EP-1784387-B1 | PHENOL COMPOUND, REVERSIBLE THERMOSENSITIVE RECORDING MEDIUM, REVERSIBLE THERMOSENSITIVE RECORDING LABEL, REVERSIBLE THERMOSENSITIVE RECORDING MEMBER, AND IMAGE-PROCESSING METHOD | RICOH CO LTD (JP) | 2013-11-06 | — | — | EP | disclosed |
| CN-102816194-A | Macrocyclic compounds and methods of making and using the same | RIB X PHARMACEUTICALS INC | 2012-12-12 | — | — | CN | disclosed |
| CN-1950388-A | Macrocyclic compounds and methods of making and using the same | RIB X PHARMACEUTICALS INC (US) | 2007-04-18 | — | — | CN | disclosed |
| EP-0644872-B1 | ORNITHINE DECARBOXYLASE INHIBITING CYCLIC AMINOOXY COMPOUNDS | CIBA GEIGY AG (CH) | 1997-03-19 | — | — | EP | disclosed |