⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6003914 | 0.84 | ALOX5 (0.31) | — | |
| Hydrochloric Acid SCHEMBL27872843 | 0.83 | ALOX5 (0.30) | — | |
| SCHEMBL17419248 | 0.81 | CNR1 (0.31) | — | |
| SCHEMBL1772836 | 0.78 | ALOX5 (0.30) | — | |
| SCHEMBL585686 | 0.72 | PTGS2 (0.35) | — | |
| SCHEMBL7262706 | 0.71 | TLR8 (0.32) | — | |
| SCHEMBL7717025 | 0.71 | — | — | |
| SCHEMBL434101 | 0.70 | KCNH2 (0.38) | — | |
| SCHEMBL7180826 | 0.68 | MEN1 (0.34) | — | |
| SCHEMBL16868830 | 0.66 | PTGS2 (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-105315699-B | Zinc purple photosensitive dye and photoelectric conversion device thereof | 财团法人工业技术研究院 | 2018-04-13 | — | — | CN | disclosed |
| US-9546278-B2 | Porphyrin photosensitive dye and photoelectric conversion device utilizing the same | INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) | 2017-01-17 | — | — | US | disclosed |
| CN-105315699-A | Zinc purple photosensitive dye and photoelectric conversion device thereof | IND TECH RES INST | 2016-02-10 | — | — | CN | disclosed |
| US-20160009921-A1 | PORPHYRIN PHOTOSENSITIVE DYE AND PHOTOELECTRIC CONVERSION DEVICE UTILIZING THE SAME | INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) | 2016-01-14 | — | — | US | disclosed |