Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 3/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | TP53 | P04637 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | TSHR | P16473 | 3/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.51 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | NQO1 | P15559 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| 1,3-Dipropoxybenzene SCHEMBL73716 | 0.93 | KMT2A (0.63) | MAPK1CYP1A2CYP2D6CYP2C19TP53 | |
| 1-Butyloxy-3-Ethoxybenzene SCHEMBL3459049 | 0.89 | MAPK1 (0.62) | MAPK1CYP1A2CYP2D6CYP2C19TP53 | |
| 1,3-Diethoxybenzene SCHEMBL1100167 | 0.89 | TP53 (0.71) | MAPK1CYP1A2CYP2D6CYP2C19TP53 | |
| SCHEMBL9487763 | 0.87 | KMT2A (0.58) | MAPK1CYP1A2CYP2D6CYP2C19KMT2A | |
| 1-Butyloxy-3-Propoxybenzene SCHEMBL3390925 | 0.87 | TSHR (0.59) | MAPK1CYP1A2CYP2D6CYP2C19KMT2A | |
| 1-Hydroxy-3-Propoxybenzene SCHEMBL7605942 | 0.87 | CHRNB2 (0.60) | MAPK1CYP1A2CYP2D6CYP2C19TP53 | |
| SCHEMBL10027326 | 0.86 | NQO1 (0.50) | MAPK1CYP1A2CYP2D6CYP2C19TP53 | |
| SCHEMBL15923791 | 0.86 | TSHR (0.69) | MAPK1CYP1A2CYP2D6CYP2C19TP53 | |
| 1-Butyloxy-3-Ethoxybenzene SCHEMBL27446094 | 0.86 | MAPK1 (0.58) | MAPK1CYP1A2CYP2D6CYP2C19TP53 | |
| 1-Ethoxy-3-Pentoxybenzene SCHEMBL3967143 | 0.86 | TSHR (0.64) | MAPK1CYP1A2CYP2D6CYP2C19TP53 |
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 |
|---|---|---|---|---|---|---|---|
| US-8188216-B2 | Combinatorial synthesis of libraries of macrocyclic compounds useful in drug discovery | TRANZYME PHARMA INC. (CA) | 2012-05-29 | — | — | US | disclosed |
| US-20100190865-A1 | METHODS AND COMPOSITIONS FOR CONTROL OF GYPSY MOTHS, Lymanria dispar | SIMON FRASER UNIVERSITY (CA) | 2010-07-29 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20100190865-A1 | METHODS AND COMPOSITIONS FOR CONTROL OF GYPSY MOTHS, Lymanria dispar | L3MBTL3, L3MBTL4, L3MBTL1 | MAPK1 4550/4885CYP1A2 2220/4885CYP2D6 2962/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.