Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | ACAT1 | P24752 | 1/20 | 0.47 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.47 |
| ▸ | CNR1 | P21554 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8856294 | 1.00 | KDM4E (0.47) | KDM4ETP53CYP3A4MAPTALOX15 | |
| SCHEMBL8856261 | 0.89 | KDM4E (0.53) | KDM4ETP53CYP3A4MAPTALOX15 | |
| SCHEMBL9498134 | 0.84 | KDM4E (0.52) | KDM4ETP53CYP3A4MAPTALOX15 | |
| SCHEMBL9498121 | 0.84 | KDM4E (0.52) | KDM4ETP53CYP3A4MAPTALOX15 | |
| SCHEMBL8856463 | 0.78 | KDM4E (0.63) | KDM4ETP53CYP3A4MAPTALOX15 | |
| SCHEMBL9498564 | 0.77 | CNR1 (0.66) | KDM4ETP53CYP3A4MAPTALOX15 | |
| SCHEMBL9446334 | 0.77 | CNR1 (0.66) | KDM4ETP53CYP3A4MAPTALOX15 | |
| SCHEMBL9498071 | 0.77 | CNR1 (0.66) | KDM4ETP53CYP3A4MAPTALOX15 | |
| SCHEMBL9446331 | 0.77 | CNR1 (0.66) | KDM4ETP53CYP3A4MAPTALOX15 | |
| SCHEMBL9498573 | 0.77 | CNR1 (0.66) | KDM4ETP53CYP3A4MAPTALOX15 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1991004027-A1 | NEW N-ARYL AND N-HETEROARYLAMIDE AND UREA DERIVATIVES AS INHIBITORS OF ACYL COENZYME A: CHOLESTEROL ACYL TRANSFERASE (ACAT) | PFIZER INC. (US) | 1991-04-04 | — | — | WO | disclosed |
| EP-0418071-A2 | New N-aryl and N-heteroarylamide and urea derivatives as inhibitors of acyl coenzyme A: cholesterol acyl transferase | PFIZER INC. (US) | 1991-03-20 | — | — | EP | disclosed |