Predicted protein targets (top 2)
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL2034414 | 0.90 | — | — | |
| SCHEMBL4493350 | 0.80 | KCNH3 (0.33) | KCNH3CYP1A2 | |
| SCHEMBL11599928 | 0.80 | CYP1A2 (0.49) | CYP1A2 | |
| SCHEMBL10158346 | 0.80 | KCNH3 (0.33) | KCNH3CYP1A2 | |
| SCHEMBL18557973 | 0.80 | KCNH3 (0.33) | KCNH3CYP1A2 | |
| SCHEMBL13439132 | 0.80 | KCNH3 (0.33) | KCNH3CYP1A2 | |
| SCHEMBL11380065 | 0.80 | KCNH3 (0.33) | KCNH3CYP1A2 | |
| SCHEMBL1927524 | 0.79 | — | — | |
| SCHEMBL6256848 | 0.78 | KCNH3 (0.33) | KCNH3CYP1A2 | |
| SCHEMBL1759484 | 0.78 | CYP1A2 (0.56) | CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6207862-B1 | PRECURSORS ARE CHIRAL 4-HYDROXYCARBOXAMIDES, 4-HYDROXYHYDROXAMIC ACIDS, OR 4-HYDROXYHYDRAZIDES PRODUCED FROM GAMMA-LACTONES, WHICH IN TURN ARE DERIVED FROM 1,4-DIOLS BY STEREOSELECTIVE OXIDATION, | BIOCATALYTICS, INC. | 2001-03-27 | — | — | US | disclosed |
| WO-1999032649-A1 | METHODS AND PRECURSORS FOR THE PRODUCTION OF CHIRAL 1,3-AMINOALCOHOLS | BIOCATALYTICS, INC. (US) | 1999-07-01 | — | — | WO | disclosed |
| US-5916786-A | Method for the production of chiral 1,3-aminoalcohols | BIOCATALYTICS, INC. (US) | 1999-06-29 | — | — | US | disclosed |