⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL537405 | 1.00 | — | — | |
| SCHEMBL537406 | 1.00 | — | — | |
| SCHEMBL4232225 | 0.91 | — | — | |
| SCHEMBL4181069 | 0.91 | — | — | |
| SCHEMBL1652304 | 0.91 | — | — | |
| SCHEMBL1904390 | 0.88 | FAAH (0.54) | — | |
| SCHEMBL1043631 | 0.88 | FAAH (0.54) | — | |
| SCHEMBL1615635 | 0.88 | — | — | |
| SCHEMBL771891 | 0.88 | FAAH (0.54) | — | |
| SCHEMBL14830401 | 0.88 | FAAH (0.54) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016195459-A2 | POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME | 주식회사 엘지화학 | 2016-12-08 | — | — | WO | disclosed |
| WO-2016176560-A1 | CHROMIUM-MEDIATED COUPLING AND APPLICATION TO THE SYNTHESIS OF HALICHONDRINS | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2016-11-03 | — | — | WO | disclosed |
| WO-2014037340-A1 | USE OF SUBSTITUTED 2-AMIDOBENZIMIDAZOLES, 2-AMIDOBENZOXAZOLES AND 2-AMIDOBENZOTHIAZOLES OR SALTS THEREOF AS ACTIVE SUBSTANCES AGAINST ABIOTIC PLANT STRESS | BAYER CROPSCIENCE AG (DE) | 2014-03-13 | — | — | WO | disclosed |
| EP-1230207-B1 | METATHESIS SYNTHESES OF PHEROMONES OR THEIR COMPONENTS | PEDERSON RICHARD L (US) | 2005-06-22 | — | — | EP | disclosed |
| US-6696597-B2 | CROSS-METATHESIZING A TERMINAL OLEFIN AND INTERNAL OLEFIN IN PRESENCE OF CATALYST, TO FORM METATHESIS PRODUCT AND A SIDE PRODUCT; APPLYING CONDITIONS OF SUFFICIENTLY HIGH TEMPERATURE AND/OR LOW PRESSURE TO EVAPORTE SIDE PRODUCT | TILLIECHEM, INC. | 2004-02-24 | — | — | US | disclosed |
| EP-1230207-A2 | METATHESIS SYNTHESES OF PHEROMONES OR THEIR COMPONENTS | Pederson, Richard L. (US) | 2002-08-14 | — | — | EP | disclosed |
| US-20020022741-A1 | Metathesis syntheses of pheromones or their components | MATERIA, INC. | 2002-02-21 | — | — | US | disclosed |
| WO-2001036368-A2 | METATHESIS SYNTHESES OF PHEROMONES OR THEIR COMPONENTS | PEDERSON RICHARD L (US) | 2001-05-25 | — | — | WO | disclosed |
| US-3988358-A | Process for the preparation of carboxylic acid esters from organic halides | THE UNIVERSITY OF DELAWARE (US) | 1976-10-26 | — | — | US | disclosed |