⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7220686 | 0.93 | — | — | |
| SCHEMBL7226518 | 0.90 | KDM4E (0.31) | — | |
| SCHEMBL7225877 | 0.85 | — | — | |
| SCHEMBL7219383 | 0.78 | — | — | |
| SCHEMBL7220088 | 0.76 | GABRG2 (0.31) | — | |
| SCHEMBL7225765 | 0.74 | CRHR1 (0.33) | — | |
| SCHEMBL7228064 | 0.72 | CRHR1 (0.45) | — | |
| SCHEMBL5599988 | 0.68 | CRHR1 (0.36) | — | |
| SCHEMBL7227610 | 0.64 | CRHR1 (0.53) | — | |
| SCHEMBL7220553 | 0.61 | CRHR1 (0.32) | — |
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-1103553-A2 | Substituted heterocyclic derivatives | Pfizer Products Inc. (US) | 2001-05-30 | — | — | EP | claimed |
| US-6525067-B1 | Corticotropin releasing factor antagonists; such as 1-(2-methyl-8-(2,4,6-trimethyl-phenyl)-quinolin-4-yl)-propan-1-one-oxime | PFIZER INC | 2003-02-25 | — | — | US | disclosed |
| EP-1103553-A2 | Substituted heterocyclic derivatives | Pfizer Products Inc. (US) | 2001-05-30 | — | — | EP | disclosed |