Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | KIF11 | P52732 | 3/20 | 0.46 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.46 |
| ▸ | ITGB1 | P05556 | 2/20 | 0.46 |
| ▸ | ITGAV | P06756 | 2/20 | 0.46 |
| ▸ | ITGA5 | P08648 | 2/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.46 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.46 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.44 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.44 |
| ▸ | ITGB6 | P18564 | 1/20 | 0.44 |
| ▸ | ITGAL | P20701 | 1/20 | 0.44 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.44 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL5309778 | 0.87 | HPGD (0.54) | KDM4ESMN1; SMN2HPGDLMNAHTT | |
| Trifluoroacetic Acid SCHEMBL5315182 | 0.86 | SMN1; SMN2 (0.54) | KDM4ESMN1; SMN2ITGB3ITGB1ITGAV | |
| Trifluoroacetic Acid SCHEMBL2480625 | 0.86 | HTR6 (0.55) | SMN1; SMN2ALDH1A1KIF11KEAP1 | |
| SCHEMBL1752626 | 0.85 | HPGD (0.70) | KDM4ESMN1; SMN2HPGDALDH1A1LMNA | |
| Hydrochloric Acid SCHEMBL1998551 | 0.84 | HPGD (0.68) | KDM4ESMN1; SMN2HPGDALDH1A1LMNA | |
| Trifluoroacetic Acid SCHEMBL5307840 | 0.81 | HTR6 (0.61) | ALDH1A1KEAP1CA12CA1CA2 | |
| Trifluoroacetic Acid SCHEMBL5311009 | 0.78 | ITGB3 (0.54) | SMN1; SMN2ALDH1A1HTTITGB3ITGB1 | |
| Trifluoroacetic Acid SCHEMBL5315234 | 0.76 | ALDH1A1 (0.45) | SMN1; SMN2ALDH1A1KIF11 | |
| Trifluoroacetic Acid SCHEMBL4640607 | 0.76 | KDM4E (0.49) | KDM4ESMN1; SMN2HPGDALDH1A1LMNA | |
| Trifluoroacetic Acid SCHEMBL7850280 | 0.75 | ALDH1A1 (0.48) | KDM4ESMN1; SMN2ALDH1A1ITGB3ITGB1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8071650-B2 | Vanilloid receptor modulators; analgesic, antiinflammatory and antiulcer effects; such as 1-(1H-indol-5-ylmethyl)-3-phenethylthiourea | PACIFIC CORPORATION (KR) | 2011-12-06 | — | — | US | disclosed |
| US-20080064687-A1 | Novel thiourea derivatives and the pharmaceutical compositions containing the same | SUH YOUNG G | 2008-03-13 | — | — | US | disclosed |
| WO-2007047575-A2 | PHARMACOLOGICAL TREATMENTS FOR SLEEP-RELATED BREATHING DISORDERS | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) | 2007-04-26 | — | — | 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-20080064687-A1 | Novel thiourea derivatives and the pharmaceutical compositions containing the same | TRPV1, TRPA1, TAS2R5 | KDM4E 4511/4885SMN1; SMN2 1383/4885HPGD 1443/4885 |
“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.