Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | FDPS | P14324 | 1/20 | 0.43 |
| ▸ | APP | P05067 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | CYP1A1 | P04798 | 4/20 | 0.42 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.42 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.42 |
| ▸ | TUBB | P07437 | 1/20 | 0.42 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.42 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.42 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.42 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| 3,4-Dimethoxybenzaldehyde SCHEMBL2370925 | 0.86 | ALDH1A1 (0.74) | ALDH1A1TSHRFDPSGAATDP1 | |
| SCHEMBL704683 | 0.84 | ALDH1A1 (0.40) | ALDH1A1TSHRFDPSAPPKDM4E | |
| 3,4-Dimethoxybenzaldehyde SCHEMBL2370931 | 0.83 | ALDH1A1 (0.81) | ALDH1A1TSHRFDPSGAATDP1 | |
| 3,4-Dimethoxybenzaldehyde SCHEMBL13290624 | 0.83 | ALDH1A1 (0.81) | ALDH1A1TSHRFDPSGAATDP1 | |
| SCHEMBL12055850 | 0.75 | VCP (0.51) | ALDH1A1TSHRAPPGAATDP1 | |
| SCHEMBL17370918 | 0.74 | JUN (0.66) | ALDH1A1TSHRGAATDP1KDM4E | |
| SCHEMBL703866 | 0.74 | ALDH1A1 (0.62) | ALDH1A1TSHRFDPSGAATDP1 | |
| SCHEMBL4146797 | 0.73 | VCP (0.79) | ALDH1A1TDP1MAPK1KDM4ESMN1; SMN2 | |
| SCHEMBL15580939 | 0.72 | ALDH1A1 (0.53) | ALDH1A1TSHRFDPSTDP1KDM4E | |
| Vanillin SCHEMBL29420568 | 0.72 | ALDH1A1 (0.73) | ALDH1A1TSHRAPPGAATDP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8575221-B2 | Derivatives of dimethylcurcumin | CONCERT PHARMACEUTICALS, INC. (US) | 2013-11-05 | — | — | US | disclosed |
| US-8084464-B2 | Tetrahydroisoquinoline derivatives | CONCERT PHARMACEUTICALS, INC. (US) | 2011-12-27 | — | — | US | disclosed |
| US-20110257271-A1 | DERIVATIVES OF DIMETHYLCURCUMIN | CONCERT PHARMACEUTICALS, INC. | 2011-10-20 | — | — | US | disclosed |
| US-20090192188-A1 | TETRAHYDROISOQUINOLINE DERIVATIVES | SUN PHARMACEUTICAL INDUSTRIES, INC. | 2009-07-30 | — | — | 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 (2 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-20090192188-A1 | TETRAHYDROISOQUINOLINE DERIVATIVES | HCRTR2, HCRTR1, OXTR | ALDH1A1 1612/4885TSHR 932/4885FDPS 4517/4885 |
| US-20110257271-A1 | DERIVATIVES OF DIMETHYLCURCUMIN | UROD, UGT1A1, UGT1A3 | ALDH1A1 319/4885TSHR 4266/4885FDPS 153/4885 |
“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.