Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.31 |
| ▸ | UGT2B7 | P16662 | 1/20 | 0.30 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | FYN | P06241 | 1/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | AHR | P35869 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | CASP1 | P29466 | 1/20 | 0.30 |
| ▸ | CASP7 | P55210 | 1/20 | 0.30 |
| ▸ | HBB | P68871 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1487793 | 0.77 | CYP1B1 (0.32) | CYP1B1ALDH1A1HIF1AHSD17B10CYP1A1 | |
| SCHEMBL1487794 | 0.75 | CYP1A1 (0.31) | CYP1B1CYP1A1UGT2B7 | |
| SCHEMBL3723965 | 0.75 | NQO1 (0.32) | CYP1B1CYP1A1UGT2B7 | |
| SCHEMBL27770259 | 0.73 | ALDH1A1 (0.32) | CYP1B1ALDH1A1HIF1AHSD17B10UGT2B7 | |
| SCHEMBL27780597 | 0.71 | ALDH1A1 (0.38) | CYP1B1ALDH1A1HIF1AHSD17B10CYP1A1 | |
| SCHEMBL7944103 | 0.71 | ALDH1A1 (0.40) | CYP1B1ALDH1A1HIF1AHSD17B10CYP1A1 | |
| SCHEMBL27860879 | 0.69 | ALDH1A1 (0.39) | CYP1B1ALDH1A1HIF1AHSD17B10CYP1A1 | |
| SCHEMBL28390957 | 0.69 | ALDH1A1 (0.35) | CYP1B1ALDH1A1HIF1AHSD17B10CYP1A1 | |
| SCHEMBL27991889 | 0.68 | CYP1A2 (0.32) | CYP1B1ALDH1A1HIF1AHSD17B10CYP1A2 | |
| SCHEMBL2834902 | 0.67 | ALDH1A1 (0.40) | CYP1B1ALDH1A1HIF1AHSD17B10CYP1A1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102124015-B | Silylethynyl pentacene compounds and compositions, and methods of making and using the same | 3M INNOVATIVE PROPERTIES CO | 2015-03-11 | — | — | CN | disclosed |
| EP-2307427-B1 | SILYLETHYNYL PENTACENE COMPOUNDS AND COMPOSITIONS AND METHODS OF MAKING AND USING THE SAME | 3M INNOVATIVE PROPERTIES CO (US) | 2015-02-18 | — | — | EP | disclosed |
| US-8956555-B2 | Silylethynyl pentacene compounds and compositions and methods of making and using the same | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2015-02-17 | — | — | US | disclosed |
| EP-2307427-A1 | SILYLETHYNYL PENTACENE COMPOUNDS AND COMPOSITIONS AND METHODS OF MAKING AND USING THE SAME | 3M Innovative Properties Company (US) | 2011-04-13 | — | — | EP | disclosed |
| US-20110073813-A1 | Silylethynyl Pentacene Compounds and Compositions and Methods of Making and Using the Same | 3M INNOVATIVE PROPERTIES COMPANY | 2011-03-31 | — | — | US | disclosed |
| WO-2009155106-A1 | SILYLETHYNYL PENTACENE COMPOUNDS AND COMPOSITIONS AND METHODS OF MAKING AND USING THE SAME | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2009-12-23 | — | — | 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-20110073813-A1 | Silylethynyl Pentacene Compounds and Compositions and Methods of Making and Using the Same | SRM, GMNN, SRI | CYP1B1 1281/4885ALDH1A1 2100/4885HIF1A 4833/4885 |
“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.