⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16787173 | 0.88 | KDM4E (0.30) | — | |
| SCHEMBL16787215 | 0.86 | DRD2 (0.30) | — | |
| SCHEMBL16787195 | 0.85 | — | — | |
| SCHEMBL16787163 | 0.84 | — | — | |
| SCHEMBL20150640 | 0.84 | ENPP1 (0.37) | — | |
| SCHEMBL20150615 | 0.81 | CA12 (0.34) | — | |
| SCHEMBL16787182 | 0.81 | ENPP3 (0.32) | — | |
| SCHEMBL16787205 | 0.80 | ENPP3 (0.31) | — | |
| SCHEMBL20150608 | 0.78 | PPARG (0.33) | — | |
| SCHEMBL20150610 | 0.77 | CA12 (0.36) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20150162542-A1 | COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME AND DISPLAY INCLUDING THE ORGANIC LIGHT EMITTING DIODE | SAMSUNG SDI CO., LTD. (KR) | 2015-06-11 | — | — | US | disclosed |
| US-20150162542-A1 | COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME AND DISPLAY INCLUDING THE ORGANIC LIGHT EMITTING DIODE | SAMSUNG SDI CO., LTD. (KR) | 2015-06-11 | — | — | US | disclosed |