⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4400798 | 1.00 | — | — | |
| SCHEMBL20726199 | 1.00 | — | — | |
| Bromide SCHEMBL27383002 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL4749389 | 0.97 | — | — | |
| Cyclohexane SCHEMBL28970052 | 0.94 | ALDH1A1 (0.35) | — | |
| SCHEMBL27522667 | 0.82 | — | — | |
| SCHEMBL10203179 | 0.80 | — | — | |
| SCHEMBL2345572 | 0.80 | — | — | |
| SCHEMBL25640283 | 0.80 | — | — | |
| SCHEMBL16078917 | 0.80 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2551288-B1 | EPOXY RESIN COMPOSITION FOR USE IN A CARBON-FIBER-REINFORCED COMPOSITE MATERIAL, PREPREG, AND CARBON-FIBER-REINFORCED COMPOSITE MATERIAL | TORAY INDUSTRIES (JP) | 2016-06-01 | — | — | EP | disclosed |
| US-8288423-B2 | FXa inhibitors with cyclic amidines as P4 subunit, processes for their preparations, and pharmaceutical compositions and derivatives thereof | LEGOCHEM BIOSCIENCE LTD. (KR) | 2012-10-16 | — | — | US | disclosed |
| US-20100184781-A1 | FXA INHIBITORS WITH CYCLIC AMIDINES AS P4 SUBUNIT, PROCESSES FOR THEIR PREPARATIONS, AND PHARMACEUTICAL COMPOSITIONS AND DERIVATIVES THEREOF | LEGOCHEM BIOSCIENCE LTD. (KR) | 2010-07-22 | — | — | US | disclosed |