Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR3 | P49682 | 1/20 | 0.40 |
| ▸ | ADAMTS5 | Q9UNA0 | 10/20 | 0.39 |
| ▸ | MMP2 | P08253 | 4/20 | 0.39 |
| ▸ | MMP13 | P45452 | 3/20 | 0.39 |
| ▸ | TACR3 | P29371 | 6/20 | 0.38 |
| ▸ | TACR1 | P25103 | 4/20 | 0.38 |
| ▸ | TACR2 | P21452 | 3/20 | 0.38 |
| ▸ | ADAM17 | P78536 | 4/20 | 0.38 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6248124 | 0.83 | MMP2 (0.42) | CXCR3ADAMTS5MMP2MMP13CYP19A1 | |
| SCHEMBL6139175 | 0.78 | CYP19A1 (0.45) | CYP19A1 | |
| Hydrochloric Acid SCHEMBL7505934 | 0.77 | CYP19A1 (0.44) | CYP19A1 | |
| SCHEMBL7505925 | 0.75 | CYP19A1 (0.45) | CYP19A1 | |
| SCHEMBL7749347 | 0.71 | CYP19A1 (0.43) | CXCR3CYP19A1 | |
| SCHEMBL23719007 | 0.69 | NPC1 (0.58) | — | |
| SCHEMBL11847657 | 0.68 | ALDH1A1 (0.54) | CYP19A1 | |
| SCHEMBL6246501 | 0.66 | CYP19A1 (0.52) | CYP19A1 | |
| SCHEMBL23719046 | 0.65 | GFER (0.58) | — | |
| SCHEMBL24855387 | 0.64 | TACR2 (0.81) | TACR3TACR1TACR2 |
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-1140841-B1 | 3-PHENYL-2,6-DIOXOPIPERIDIN-3-YL PROPIONAMIDE DERIVATIVES AND METHOD FOR PREPARING SAME | SANOFI AVENTIS (FR) | 2005-08-17 | — | — | EP | disclosed |
| US-6452012-B1 | USEFULL CHEMICAL INTERMEDIATES FOR SYNTHESIS OF NEUROKININ ANTAGONISTS | SANOFI-SYNTHELABO (FR) | 2002-09-17 | — | — | US | disclosed |
| US-6342607-B1 | INTERMEDIATES FOR PREPARATION OF NEUROKININ ANTAGONISTS | SANOFI-SYNTHELABO (FR) | 2002-01-29 | — | — | US | disclosed |