⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17858277 | 1.00 | — | — | |
| SCHEMBL12127156 | 0.94 | — | — | |
| SCHEMBL12948269 | 0.92 | LMNA (0.38) | — | |
| SCHEMBL18211204 | 0.87 | — | — | |
| SCHEMBL2631302 | 0.87 | — | — | |
| SCHEMBL1805229 | 0.83 | LMNA (0.50) | — | |
| SCHEMBL2686925 | 0.83 | LMNA (0.50) | — | |
| SCHEMBL25219783 | 0.82 | LMNA (0.39) | — | |
| SCHEMBL4452016 | 0.80 | LMNA (0.47) | — | |
| SCHEMBL31730270 | 0.80 | LMNA (0.47) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3181569-A1 | BENZOBIS(THIADIAZOLE) DERIVATIVE, INK CONTAINING SAME, AND ORGANIC ELECTRONIC DEVICE USING SAME | UBE Industries, Ltd. (JP) | 2017-06-21 | — | — | EP | disclosed |
| WO-2016100281-A1 | INDOLE AND AZAINDOLES DERIVATIVES AND THEIR USE IN NEURODEGENERATIVE DISEASES | MERCK PATENT GMBH (DE) | 2016-06-23 | — | — | WO | disclosed |
| US-20160009789-A1 | NEUTRALIZING ANTIBODIES TO HIV-1 AND THEIR USE | UNIVERSITY OF WASHINGTON (US) | 2016-01-14 | — | — | US | disclosed |
| WO-2011078413-A1 | SEVEN-MEMBERED RING COMPOUND AND PHARMACEUTICAL USE THEREFOR | 第一三共株式会社 (JP) | 2011-06-30 | — | — | WO | disclosed |
| EP-1281744-B1 | Emissive polymers and devices incorporating these polymers | MASSACHUSETTS INST TECHNOLOGY (US) | 2008-09-24 | — | — | EP | disclosed |