⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5919307 | 0.67 | — | — | |
| SCHEMBL1416539 | 0.59 | — | — | |
| SCHEMBL1960310 | 0.59 | — | — | |
| SCHEMBL4548057 | 0.59 | — | — | |
| SCHEMBL425052 | 0.59 | — | — | |
| SCHEMBL6751896 | 0.59 | — | — | |
| SCHEMBL9261963 | 0.56 | — | — | |
| SCHEMBL17707877 | 0.56 | — | — | |
| SCHEMBL20384146 | 0.56 | — | — | |
| SCHEMBL268403 | 0.56 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3074400-B1 | OCTAHYDRO-CYCLOBUTA [1,2-C;3,4-C']DIPYRROLE DERIVATIVES AS AUTOTAXIN INHIBITORS | HOFFMANN LA ROCHE (CH) | 2017-11-15 | — | — | EP | disclosed |
| US-20170306056-A1 | NANOCRYSTALLINE CELLULOSE, ITS PREPARATION AND USES OF SUCH NANOCRYSTALLINE CELLULOSE | TECHNISCHE UNIVERSITAT MUNCHEN (DE) | 2017-10-26 | — | — | US | disclosed |
| US-20160138032-A1 | POACEAE PLANT WHOSE FLOWERING TIME IS CONTROLLABLE | NATIONAL INSTITUTE OF AGROBIOLOGICAL SCIENCES (JP) | 2016-05-19 | — | — | US | disclosed |
| US-20150322433-A1 | POST-SYNTHETIC ORTHOGANAL AMIDATION PLUS METAL CATALYZED AZIDE-ALKYNE CYCLOADDITION CLICK CHEMISTRY ON siRNA | SIRNA THERAPEUTICS, INC. (US) | 2015-11-12 | — | — | US | disclosed |
| EP-2785696-B1 | NOVEL COMPOUNDS | BOEHRINGER INGELHEIM INT (DE) | 2015-09-23 | — | — | EP | disclosed |
| EP-2279753-B1 | Remodeling and glycoconjugation of peptides | NOVO NORDISK AS (DK) | 2015-09-16 | — | — | EP | disclosed |
| US-8901345-B2 | Process for preparation of optically active diamine derivative salt | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2014-12-02 | — | — | US | disclosed |
| EP-2305217-B1 | Method for the preparation of pharmaceutical compositions comprising a solid amorphous dispersion of cholesteryl ester transfer protein inhibitors | BEND RES INC (US) | 2014-07-30 | — | — | EP | disclosed |
| US-20140036730-A1 | ADAPTIVE INFRASTRUCTURE FOR DISTRIBUTED VIRTUAL SWITCH | CISCO TECHNOLOGY, INC. (US) | 2014-02-06 | — | — | US | disclosed |
| WO-2013130880-A1 | HYPERMETHYLATED GENE MARKERS FOR HEAD AND NECK CANCER | THE JOHNS HOPKINS UNIVERSITY (US) | 2013-09-06 | — | — | WO | disclosed |
| WO-2013109388-A2 | 1,5-NAPHTHYRIDINE DERIVATIVES AND MELK INHIBITORS CONTAINING THE SAME | ONCOTHERAPY SCIENCE, INC. (JP) | 2013-07-25 | — | — | WO | disclosed |
| US-20120238752-A1 | COMPOUND OR ITS TAUTOMER, METAL COMPLEX COMPOUND, COLORED PHOTOSENSITIVE CURING COMPOSITION, COLOR FILTER, AND PRODUCTION | FUJIFILM CORPORATION (JP) | 2012-09-20 | — | — | US | disclosed |
| US-8193123-B2 | Articles having localized molecules disposed thereon and methods of producing same | PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) | 2012-06-05 | — | — | US | disclosed |
| US-20110218104-A1 | Biodiesel Solvents in Pesticide Compositions | AUBURN UNIVERSITY (US) | 2011-09-08 | — | — | US | disclosed |
| US-20080176769-A1 | Articles having localized molecules disposed thereon and methods of producing same | PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) | 2008-07-24 | — | — | US | disclosed |