⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8906745 | 0.70 | — | — | |
| SCHEMBL10602562 | 0.70 | HSD17B10 (0.31) | — | |
| SCHEMBL2230309 | 0.69 | — | — | |
| SCHEMBL15774 | 0.67 | — | — | |
| SCHEMBL4694513 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL9104149 | 0.67 | — | — | |
| SCHEMBL12544435 | 0.67 | ADRB2 (0.33) | — | |
| SCHEMBL8815842 | 0.65 | LMNA (0.32) | — | |
| SCHEMBL15654806 | 0.65 | LMNA (0.32) | — | |
| SCHEMBL10789885 | 0.65 | LMNA (0.32) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007076014-A2 | THERMAL MANAGEMENT CIRCUIT MATERIALS, METHOD OF MANUFACTURE THEREOF, AND ARTICLES FORMED THEREFROM | WORLD PROPERTIES, INC. (US) | 2007-07-05 | — | — | WO | disclosed |
| EP-0742269-B1 | Halogenindium phthalocyanine crystals | XEROX CORP (US) | 2001-10-10 | — | — | EP | disclosed |
| US-5830613-A | Electrophotographic imaging member having laminated layers | XEROX CORPORATION (US) | 1998-11-03 | — | — | US | disclosed |
| EP-0742269-A1 | Halogenindium phthalocyanine crystals | XEROX CORPORATION (US) | 1996-11-13 | — | — | EP | disclosed |
| US-5529870-A | Halogenindium phthalocyanine crystals | XEROX CORPORATION (US) | 1996-06-25 | — | — | US | disclosed |