Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.52 |
| ▸ | HTR1B | P28222 | 7/20 | 0.51 |
| ▸ | HTR1D | P28221 | 2/20 | 0.49 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.45 |
| ▸ | HRH1 | P35367 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL24168814 | 0.95 | MCHR1 (0.54) | CYP1A2CYP2C9CYP2C19MCHR1HTR1B | |
| SCHEMBL30539214 | 0.95 | MCHR1 (0.54) | CYP1A2CYP2C9CYP2C19MCHR1HTR1B | |
| SCHEMBL1807259 | 0.85 | ALDH1A1 (0.52) | HTR1BTLR8TSHRKDM4EMEN1 | |
| SCHEMBL2792602 | 0.84 | HTR1B (0.46) | HTR1BHTR1DSLC6A4HRH1PLAU | |
| SCHEMBL15772640 | 0.84 | KCNA3 (0.54) | CYP1A2CYP2C9CYP2C19MCHR1HTR1B | |
| SCHEMBL29447160 | 0.84 | KCNA3 (0.54) | CYP1A2CYP2C9CYP2C19MCHR1HTR1B | |
| SCHEMBL12968235 | 0.83 | HTR1B (0.52) | CYP1A2CYP2C9CYP2C19MCHR1HTR1B | |
| SCHEMBL7823166 | 0.83 | HTR1B (0.52) | CYP1A2CYP2C9CYP2C19MCHR1HTR1B | |
| SCHEMBL9017754 | 0.82 | HTR1B (0.54) | CYP1A2CYP2C9CYP2C19MCHR1HTR1B | |
| SCHEMBL7823164 | 0.81 | HTR1B (0.51) | CYP1A2CYP2C9CYP2C19MCHR1HTR1B |
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-8404036-B2 | Water-soluble near-infrared absorbing coloring matters and aqueous inks containing same | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 2013-03-26 | — | — | US | disclosed |
| US-20110123784-A1 | WATER-SOLUBLE NEAR-INFRARED ABSORBING COLORING MATTERS AND AQUEOUS INKS CONTAINING SAME | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 2011-05-26 | — | — | 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-20110123784-A1 | WATER-SOLUBLE NEAR-INFRARED ABSORBING COLORING MATTERS AND AQUEOUS INKS CONTAINING SAME | IK, RB1, COL1A1 | CYP1A2 487/4885CYP2C9 692/4885CYP2C19 887/4885 |
“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.