⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19667831 | 0.81 | KDM4E (0.48) | — | |
| SCHEMBL3425605 | 0.79 | — | — | |
| Dimethyl Sulfoxide SCHEMBL28118530 | 0.79 | CTSD (0.52) | — | |
| SCHEMBL9857528 | 0.78 | CTSD (0.52) | — | |
| SCHEMBL22561256 | 0.76 | FAAH (0.47) | — | |
| SCHEMBL8310114 | 0.73 | — | — | |
| SCHEMBL19682728 | 0.72 | CTSD (0.41) | — | |
| SCHEMBL220310 | 0.71 | KDM4E (0.77) | — | |
| SCHEMBL186925 | 0.70 | — | — | |
| SCHEMBL1169405 | 0.70 | — | — |
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-10697977-B2 | Mass spectrometry-cleavable cross-linker | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2020-06-30 | — | — | US | disclosed |
| US-20170350901-A1 | MASS SPECTROMETRY-CLEAVABLE CROSS-LINKER | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA | 2017-12-07 | — | — | US | disclosed |
| US-6184180-B1 | COMPRISES SUPPORT, REVERSIBLE HEAT-SENSITIVE RECORDING LAYER CONTAINING DYE PRECURSOR WHICH IS COLORLESS OR A PALE COLOR, COLOR DEVELOPER CAPABLE OF CAUSING REVERSIBLE CHANGE IN COLOR DENSITY OF DYE DUE TO DIFFERENCE IN COOLING RATE | MITSUBISHI PAPER MILLS LIMITED (JP) | 2001-02-06 | — | — | US | disclosed |
| US-5817599-A | COLORLESS DYE PRECURSOR AND REVERSIBLE COLOR DEVELOPER | MITSUBISHI PAPER MILLS LIMITED (JP) | 1998-10-06 | — | — | US | disclosed |