Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMO | Q99835 | 1/20 | 0.51 |
| ▸ | DRD4 | P21917 | 4/20 | 0.50 |
| ▸ | SSTR5 | P35346 | 3/20 | 0.48 |
| ▸ | MCHR1 | Q99705 | 4/20 | 0.47 |
| ▸ | USP30 | Q70CQ3 | 3/20 | 0.45 |
| ▸ | CCR3 | P51677 | 2/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.42 |
| ▸ | HPGDS | O60760 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL16811969 | 0.92 | SMO (0.52) | SMODRD4SSTR5MAPK14KDM4E | |
| SCHEMBL16811970 | 0.91 | DRD4 (0.52) | SMODRD4SSTR5MCHR1KDM4E | |
| SCHEMBL16811974 | 0.91 | SMO (0.51) | SMODRD4SSTR5MCHR1USP30 | |
| SCHEMBL18286503 | 0.90 | SMO (0.57) | SMODRD4SSTR5MCHR1CCR3 | |
| SCHEMBL16812654 | 0.90 | SMO (0.49) | SMODRD4SSTR5MCHR1CCR3 | |
| SCHEMBL16811921 | 0.90 | SMO (0.65) | SMODRD4MCHR1USP30CCR3 | |
| SCHEMBL16811953 | 0.89 | HPGDS (0.55) | SMODRD4SSTR5MCHR1USP30 | |
| SCHEMBL16811948 | 0.89 | SMO (0.55) | SMODRD4SSTR5MCHR1CCR3 | |
| SCHEMBL16811944 | 0.88 | SMO (0.55) | SMODRD4SSTR5MCHR1KCNH2 | |
| SCHEMBL16811959 | 0.88 | HPGDS (0.55) | SMODRD4SSTR5MCHR1CCR3 |
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-9512106-B2 | Smoothened modulators and methods of use thereof | DUKE UNIVERSITY (US) | 2016-12-06 | — | — | US | disclosed |
| US-20150166509-A1 | SMOOTHENED MODULATORS AND METHODS OF USE THEREOF | UNIV DUKE (US) | 2015-06-18 | — | — | 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-20150166509-A1 | SMOOTHENED MODULATORS AND METHODS OF USE THEREOF | SMO, SHH, GLI1 | SMO 1/4885DRD4 4828/4885SSTR5 1894/4885 |
“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.