⚠ 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 | |
|---|---|---|---|---|
| Cyclooctanamine SCHEMBL27758196 | 1.00 | THRB (0.41) | — | |
| Cyclopentanamine SCHEMBL27699239 | 0.96 | — | — | |
| Cyclohexylamine SCHEMBL25428096 | 0.89 | — | — | |
| SCHEMBL20858602 | 0.89 | THRB (0.50) | — | |
| SCHEMBL20830445 | 0.89 | THRB (0.50) | — | |
| SCHEMBL21416372 | 0.89 | THRB (0.50) | — | |
| SCHEMBL24893550 | 0.89 | THRB (0.50) | — | |
| SCHEMBL23379885 | 0.89 | THRB (0.50) | — | |
| SCHEMBL20726193 | 0.89 | THRB (0.50) | — | |
| SCHEMBL23379889 | 0.89 | THRB (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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110003114-A | Diarylhydantoin compounds | 加利福尼亚大学董事会 | 2019-07-12 | — | — | CN | disclosed |
| CN-105037273-B | Diarylhydantoin compounds | 加利福尼亚大学董事会 | 2019-04-19 | — | — | CN | disclosed |
| CN-104603106-B | Indole carboxamide derivatives and uses thereof | 诺华股份有限公司 | 2017-05-10 | — | — | CN | disclosed |
| CN-103649049-B | For 3-(biphenyl-3-base)-8,8-two fluoro-hydroxyl-1-azaspiro [4.5]-3-in the last of the ten Heavenly stems alkene-2-ketone being replaced treated and the spirocyclic ketoenols being optionally substituted by halogen | 拜耳知识产权有限责任公司 | 2016-06-29 | — | — | CN | disclosed |
| CN-104603106-A | Indole carboxamide derivatives and uses thereof | NOVARTIS AG | 2015-05-06 | — | — | CN | disclosed |
| CN-103492367-B | Substituted 3- (biphenyl-3-yl) -8, 8-difluoro-4-hydroxy-1-azaspiro [4.5] dec-3-en-2-ones for use in therapy | BAYER IP GMBH | 2015-04-01 | — | — | CN | disclosed |
| CN-103649049-A | Substituted 3-(biphenyl-3-yl)-8,8-difluoro-hydroxy-1-azaspiro[4.5]dec-3-en-2-ones for therapy and halogen-substituted spirocyclic ketoenols | BAYER IP GMBH | 2014-03-19 | — | — | CN | disclosed |
| CN-103492367-A | Substituted 3- (biphenyl-3-yl) -8, 8-difluoro-4-hydroxy-1-azaspiro [4.5] dec-3-en-2-ones for use in therapy | BAYER IP GMBH | 2014-01-01 | — | — | CN | disclosed |
| CN-103476767-A | Heterocyclic compounds as PI3 kinase inhibitors | HOFFMANN LA ROCHE | 2013-12-25 | — | — | CN | disclosed |
| CN-101863794-B | 3' -alkoxy spirocyclic tetramic and tetronic acids | BAYER CROPSCIENCE AG | 2013-07-24 | — | — | CN | disclosed |
| CN-101006056-B | 3' -alkoxy spirocyclic tetramic and tetronic acids | BAYER CROPSCIENCE AG | 2012-07-25 | — | — | CN | disclosed |
| CN-101863794-A | 3' -alkoxy spirocyclic tetramic and tetronic acids | BAYER CROPSCIENCE AG | 2010-10-20 | — | — | CN | disclosed |
| CN-100575342-C | Substituted spirocyclic ketoenols | BAYER CROPSCIENCE AG | 2009-12-30 | — | — | CN | disclosed |
| CN-101006056-A | 3' -alkoxy spirocyclic tetramic and tetronic acids | BAYER CROPSCIENCE AG (DE) | 2007-07-25 | — | — | CN | disclosed |
| CN-1694869-A | Substituted spirocyclic ketoenols | BAYER CROPSCIENCE AG (DE) | 2005-11-09 | — | — | CN | disclosed |