Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | NAAA | Q02083 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.42 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.42 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.42 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.42 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Phenylacetylene SCHEMBL27630895 | 0.82 | LTA4H (0.42) | SMN1; SMN2 | |
| Benzonitrile SCHEMBL8773388 | 0.82 | SIGMAR1 (0.56) | SIGMAR1ALDH1A1TSHRCHRM2NAAA | |
| Benzonitrile SCHEMBL8746686 | 0.82 | SIGMAR1 (0.56) | SIGMAR1ALDH1A1TSHRCHRM2NAAA | |
| Biphenyl SCHEMBL5716029 | 0.79 | SIGMAR1 (0.66) | SIGMAR1ALDH1A1TSHRCHRM2NAAA | |
| Biphenyl SCHEMBL22832517 | 0.79 | SIGMAR1 (0.66) | SIGMAR1ALDH1A1TSHRCHRM2NAAA | |
| Benzene SCHEMBL28999857 | 0.78 | TSHR (0.77) | SIGMAR1ALDH1A1TSHRCHRM2NAAA | |
| Benzene SCHEMBL28999842 | 0.78 | TSHR (0.77) | SIGMAR1ALDH1A1TSHRCHRM2NAAA | |
| Biphenyl SCHEMBL27827416 | 0.77 | SIGMAR1 (0.63) | SIGMAR1ALDH1A1TSHRCHRM2NAAA | |
| Phenylacetylene SCHEMBL28009607 | 0.76 | LTA4H (0.49) | ALDH1A1TSHRCHRM2MEN1KMT2A | |
| Phenylacetylene SCHEMBL1983361 | 0.76 | DRD2 (0.40) | ALDH1A1TSHRMEN1KMT2A |
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-7842758-B2 | Conjugated materials featuring proquinoidal units | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2010-11-30 | — | — | US | disclosed |
| US-20090221762-A1 | NOVEL CONJUGATED MATERIALS FEATURING PROQUINOIDAL UNITS | THE TRUSSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2009-09-03 | — | — | US | disclosed |
| WO-2007081991-A9 | NOVEL CONJUGATED MATERIALS FEATURING PROQUINOIDAL UNITS | UNIV PENNSYLVANIA (US) | 2007-09-07 | — | — | WO | disclosed |
| WO-2007081991-A2 | NOVEL CONJUGATED MATERIALS FEATURING PROQUINOIDAL UNITS | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2007-07-19 | — | — | 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-20090221762-A1 | NOVEL CONJUGATED MATERIALS FEATURING PROQUINOIDAL UNITS | PML, ILK, PARG | SIGMAR1 2076/4885ALDH1A1 2833/4885TSHR 4843/4885 |
“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.