⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4566706 | 0.77 | — | — | |
| SCHEMBL3976323 | 0.76 | — | — | |
| SCHEMBL5881053 | 0.76 | CYP19A1 (0.35) | — | |
| SCHEMBL28253806 | 0.73 | — | — | |
| SCHEMBL28102667 | 0.71 | IDO1 (0.31) | — | |
| SCHEMBL4098083 | 0.71 | HTR2B (0.31) | — | |
| SCHEMBL28285476 | 0.70 | TTK (0.30) | — | |
| SCHEMBL3979369 | 0.70 | — | — | |
| SCHEMBL5881023 | 0.67 | — | — | |
| SCHEMBL8404010 | 0.67 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6352703-B1 | APPLYING POISON AND FEEDING STIMULANT COMPRISING NAPHTHALENE, 2,6-DI-TERT-BUTYL-4-METHYLPHENOL, ERGOSTEROL, DIOCTYL ADIPATE, AND/OR DIOCTYL PHTHALATE; INCREASED CONSUMPTION | BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE | 2002-03-05 | — | — | US | disclosed |