⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10100105 | 0.93 | — | — | |
| SCHEMBL10100094 | 0.86 | TP53 (0.31) | — | |
| SCHEMBL10100090 | 0.83 | KDM4E (0.32) | — | |
| SCHEMBL10100093 | 0.80 | — | — | |
| SCHEMBL10100102 | 0.78 | — | — | |
| SCHEMBL10100097 | 0.77 | TSHR (0.31) | — | |
| SCHEMBL10100109 | 0.75 | — | — | |
| SCHEMBL10100112 | 0.72 | — | — | |
| SCHEMBL10100096 | 0.70 | TSHR (0.31) | — | |
| SCHEMBL10100092 | 0.69 | KDM4E (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120196078-A1 | CONJUGATED POLYMER FIBER, PREPARATION AND USE THEREOF | SOTZING GREGORY A (US) | 2012-08-02 | — | — | US | disclosed |
| US-8178629-B2 | Conjugated polymer fiber, preparation and use thereof | UNIVERSITY OF CONNECTICUT (US) | 2012-05-15 | — | — | US | disclosed |
| US-20070089845-A1 | Conjugated polymer fiber, preparation and use thereof | UNIVERSITY OF CONNECTICUT | 2007-04-26 | — | — | US | disclosed |