⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17612466 | 0.71 | CYP1A2 (0.30) | — | |
| SCHEMBL14299148 | 0.68 | — | — | |
| SCHEMBL18842830 | 0.60 | HDAC1 (0.31) | — | |
| SCHEMBL12266515 | 0.59 | NOS3 (0.38) | — | |
| SCHEMBL14353700 | 0.59 | NOS3 (0.44) | — | |
| SCHEMBL13233862 | 0.58 | — | — | |
| SCHEMBL874915 | 0.57 | CCR1 (0.46) | — | |
| SCHEMBL27333834 | 0.56 | CCR1 (0.44) | — | |
| Iodide SCHEMBL28183168 | 0.56 | CCR1 (0.44) | — | |
| SCHEMBL28308505 | 0.56 | CCR1 (0.44) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10396286-B2 | Regioregular pyridal[2,1,3]thiadiazole π-conjugated copolymers for organic semiconductors | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2019-08-27 | — | — | US | disclosed |
| US-9293708-B2 | Regioregular pyridal[2,1,3]thiadiazole π-conjugated copolymers for organic semiconductors | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2016-03-22 | — | — | US | disclosed |
| US-9293708-B2 | Regioregular pyridal[2,1,3]thiadiazole π-conjugated copolymers for organic semiconductors | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2016-03-22 | — | — | US | disclosed |
| US-20140080986-A1 | REGIOREGULAR PYRIDAL[2,1,3]THIADIAZOLE PI-CONJUGATED COPOLYMERS FOR ORGANIC SEMICONDUCTORS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2014-03-20 | — | — | US | disclosed |
| US-20140080986-A1 | REGIOREGULAR PYRIDAL[2,1,3]THIADIAZOLE PI-CONJUGATED COPOLYMERS FOR ORGANIC SEMICONDUCTORS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2014-03-20 | — | — | US | disclosed |
| US-20120322966-A1 | REGIOREGULAR PYRIDAL[2,1,3]THIADIAZOLE PI-CONJUGATED COPOLYMERS FOR ORGANIC SEMICONDUCTORS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA | 2012-12-20 | — | — | US | disclosed |
| US-20120322966-A1 | REGIOREGULAR PYRIDAL[2,1,3]THIADIAZOLE PI-CONJUGATED COPOLYMERS FOR ORGANIC SEMICONDUCTORS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA | 2012-12-20 | — | — | US | disclosed |