⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21410740 | 0.88 | TRPV4 (0.30) | — | |
| SCHEMBL1133590 | 0.85 | TRPV4 (0.31) | — | |
| SCHEMBL18135474 | 0.85 | TRPV4 (0.31) | — | |
| SCHEMBL18348918 | 0.79 | TSHR (0.33) | — | |
| SCHEMBL11063464 | 0.78 | TRPV4 (0.30) | — | |
| SCHEMBL21410256 | 0.78 | KDM4E (0.30) | — | |
| SCHEMBL26382425 | 0.71 | — | — | |
| SCHEMBL12304964 | 0.70 | KDM4E (0.33) | — | |
| SCHEMBL13058558 | 0.70 | HTT (0.31) | — | |
| SCHEMBL13058553 | 0.70 | TRPV4 (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20150368194-A1 | System and Method for Fluoralkylated Fluorophthalocyanines with Aggregating Properties and Catalytic Driven Pathway for Oxidizing Thiols | GORUN SERGIU M (US) | 2015-12-24 | — | — | US | disclosed |
| US-20150315137-A1 | System and Method for Fluoroalkylated Fluorophthalocyanines With Aggregating Properties and Catalytic Driven Pathway for Oxidizing Thiols | NEW JERSEY INSTITUTE OF TECHNOLOGY (US) | 2015-11-05 | — | — | US | disclosed |
| US-20120283430-A1 | System and Method for Fluoroalkylated Fluorophthalocyanines With Aggregating Properties and Catalytic Driven Pathway for Oxidizing Thiols | NEW JERSEY INSTITUTE OF TECHNOLOGY (US) | 2012-11-08 | — | — | US | disclosed |
| WO-2012061344-A1 | SYSTEM AND METHOD FOR FLUOROALKYLATED FLUOROPHTHALOCYANINES WITH AGGREGATING PROPERTIES AND CATALYTIC DRIVEN PATHWAY FOR OXIDIZING THIOLS | NEW JERSEY INSTITUTE OF TECHNOLOGY (US) | 2012-05-10 | — | — | WO | disclosed |