⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14244664 | 0.72 | HPRT1 (0.57) | — | |
| SCHEMBL5887660 | 0.71 | HSD17B10 (0.56) | — | |
| SCHEMBL5474001 | 0.71 | HSD17B10 (0.56) | — | |
| Triphenylene SCHEMBL9979387 | 0.68 | HPRT1 (0.53) | — | |
| Triphenylene SCHEMBL11053253 | 0.68 | HPRT1 (0.53) | — | |
| Triphenylene SCHEMBL15473664 | 0.68 | HPRT1 (0.53) | — | |
| Triphenylene SCHEMBL21816705 | 0.68 | HPRT1 (0.53) | — | |
| SCHEMBL10824574 | 0.68 | HPRT1 (0.53) | — | |
| Triphenylene SCHEMBL9402308 | 0.68 | HPRT1 (0.53) | — | |
| Triphenylene SCHEMBL5388604 | 0.65 | HPRT1 (0.50) | — |
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-8114661-B2 | Electronic methods for the detection of analytes | OSMETECH TECHNOLOGY, INC. (US) | 2012-02-14 | — | — | US | disclosed |
| US-20110059535-A1 | Electronic Methods for the Detection of Analytes | OSMETECH TECHNOLOGY INC. (US) | 2011-03-10 | — | — | US | disclosed |