⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21782741 | 0.94 | — | — | |
| SCHEMBL13686439 | 0.87 | — | — | |
| SCHEMBL14943104 | 0.84 | — | — | |
| SCHEMBL27719982 | 0.81 | — | — | |
| SCHEMBL11693327 | 0.81 | CA12 (0.91) | — | |
| Hydrochloric Acid SCHEMBL8723992 | 0.77 | KDM4E (0.85) | — | |
| Water SCHEMBL28369583 | 0.77 | — | — | |
| SCHEMBL1473809 | 0.77 | CA12 (0.92) | — | |
| Trientine SCHEMBL9635022 | 0.77 | CA12 (0.92) | — | |
| SCHEMBL15381 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016044585-A1 | ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF | Epizyme, Inc. (US) | 2016-03-24 | — | — | WO | disclosed |
| US-8138339-B2 | Inhibitors of protein kinases | PORTOLA PHARMACEUTICALS, INC. (US) | 2012-03-20 | — | — | US | disclosed |
| EP-2292586-A2 | Photoelectric conversion material, film containing the material, photoelectric conversion device, production method thereof, photosensor, imaging device and their use methods | Fujifilm Corporation (JP) | 2011-03-09 | — | — | EP | disclosed |
| US-20090318407-A1 | Inhibitors of protein kinases | PORTOLA PHARMACEUTICALS, INC. (US) | 2009-12-24 | — | — | US | disclosed |