Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | KIF11 | P52732 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | DHODH | Q02127 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TGM2 | P21980 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL428217 | 0.93 | ALDH1A1 (0.56) | ALDH1A1LMNAMAPTNPC1RAB9A | |
| SCHEMBL10889869 | 0.91 | ALDH1A1 (0.54) | ALDH1A1LMNAMAPTNPC1RAB9A | |
| SCHEMBL14403087 | 0.81 | ALDH1A1 (0.45) | ALDH1A1LMNAMAPTNPC1RAB9A | |
| SCHEMBL14402927 | 0.81 | TEAD4 (0.47) | ALDH1A1LMNAMAPTNPC1RAB9A | |
| SCHEMBL469386 | 0.80 | ALDH1A1 (0.72) | ALDH1A1LMNAMAPTNPC1RAB9A | |
| SCHEMBL14418354 | 0.79 | ALDH1A1 (0.73) | ALDH1A1LMNAMAPTNPC1RAB9A | |
| SCHEMBL223423 | 0.79 | ALDH1A1 (0.73) | ALDH1A1LMNAMAPTNPC1RAB9A | |
| SCHEMBL14471636 | 0.78 | ALDH1A1 (0.42) | ALDH1A1LMNAPOLBLIMK1 | |
| SCHEMBL2322134 | 0.78 | AURKA (0.50) | KIF11LMNAMAPTMEN1KMT2A | |
| SCHEMBL2322247 | 0.77 | ALDH1A1 (0.50) | ALDH1A1KIF11LMNAMAPTNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2999699-B1 | PURINE DIONES AS WNT PATHWAY MODULATORS | AGENCY SCIENCE TECH & RES (SG) | 2020-04-29 | — | — | EP | disclosed |
| US-9079899-B2 | Anti-staphylococcal celecoxib derivatives | THE OHIO STATE UNIVERSITY (US) | 2015-07-14 | — | — | US | disclosed |
| US-20130289004-A1 | ANTI-STAPHYLOCOCCAL CELECOXIB DERIVATIVES | THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) | 2013-10-31 | — | — | US | disclosed |
| WO-2011094890-A1 | PHENYLALANINE DERIVATIVES AND THEIR USE AS NON-PEPTIDE GLP-1 RECEPTOR MODULATORS | ARGUSINA INC. (US) | 2011-08-11 | — | — | WO | 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-20130289004-A1 | ANTI-STAPHYLOCOCCAL CELECOXIB DERIVATIVES | PTGS1, IL17A, IKBKE | ALDH1A1 2417/4885KIF11 3527/4885LMNA 3471/4885 |
“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.