⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2804883 | 0.73 | — | — | |
| SCHEMBL3282414 | 0.70 | NOTUM (0.41) | — | |
| SCHEMBL7108455 | 0.69 | NOTUM (0.34) | — | |
| SCHEMBL32691742 | 0.67 | NOTUM (0.36) | — | |
| SCHEMBL6551234 | 0.66 | NOTUM (0.37) | — | |
| SCHEMBL25288671 | 0.64 | AKR1C3 (0.42) | — | |
| SCHEMBL5708142 | 0.62 | CSNK2A1 (0.36) | — | |
| SCHEMBL6238088 | 0.61 | — | — | |
| SCHEMBL5708137 | 0.59 | NR4A2 (0.40) | — | |
| SCHEMBL11213858 | 0.59 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0970239-B1 | DETECTION OF MICROBIAL METABOLITES | BIOSYNTH AG (CH) | 2004-12-08 | — | — | EP | disclosed |
| US-6068988-A | DETECTING A PHOSPHATIDYLINOSITOL-SPECIFIC PHOSPHOLIPASE C IN A SAMPLE BY CONTACTING WITH A CHROMOGENIC SUBSTRATE AND MONITORING FOR COLOR FORMATION | BIOSYNTH AG (CH) | 2000-05-30 | — | — | US | disclosed |
| US-6051391-A | SUBSTRATE FOR ANALYSIS OF PHOSPHATIDYLINOSITOL-SPECIFIC PHOSPHOLIPASE C WHICH INCLUDES 3-INDOXYL-MYO-INOSITOL-1-PHOSPHATE DERIVATIVE OR SALT; COLORIMETRIC ANALYSIS AND PLATING MEDIA | BIOSYNTH AG (CH) | 2000-04-18 | — | — | US | disclosed |