Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.74 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.74 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.65 |
| ▸ | RARB | P10826 | 3/20 | 0.63 |
| ▸ | RARG | P13631 | 3/20 | 0.63 |
| ▸ | VCP | P55072 | 1/20 | 0.56 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.55 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | RARA | P10276 | 2/20 | 0.51 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CRABP2 | P29373 | 1/20 | 0.51 |
| ▸ | CES2 | O00748 | 2/20 | 0.50 |
| ▸ | CES1 | P23141 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | ACACB | O00763 | 1/20 | 0.49 |
| ▸ | RXRA | P19793 | 1/20 | 0.48 |
| ▸ | RXRB | P28702 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL16103317 | 0.94 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2SRD5A2RARBRARG | |
| SCHEMBL29789030 | 0.89 | RARB (0.69) | ALDH1A1SMN1; SMN2SRD5A2RARBRARG | |
| SCHEMBL69572 | 0.89 | RARB (0.69) | ALDH1A1SMN1; SMN2SRD5A2RARBRARG | |
| Hydrochloric Acid SCHEMBL5666955 | 0.86 | RARB (0.67) | ALDH1A1SMN1; SMN2SRD5A2RARBRARG | |
| Terephthalic Acid SCHEMBL15994097 | 0.86 | ALDH1A1 (1.00) | ALDH1A1SMN1; SMN2SRD5A2TP53TSHR | |
| 4-Methylbenzoic Acid SCHEMBL11366477 | 0.86 | ALDH1A1 (1.00) | ALDH1A1SMN1; SMN2SRD5A2TP53TSHR | |
| 4-Methylbenzoic Acid SCHEMBL93638 | 0.86 | ALDH1A1 (1.00) | ALDH1A1SMN1; SMN2SRD5A2TP53TSHR | |
| 4-Methylbenzoic Acid SCHEMBL1331178 | 0.86 | ALDH1A1 (1.00) | ALDH1A1SMN1; SMN2SRD5A2TP53TSHR | |
| Terephthalic Acid SCHEMBL526449 | 0.86 | ALDH1A1 (1.00) | ALDH1A1SMN1; SMN2SRD5A2TP53TSHR | |
| 4-Methylbenzoic Acid SCHEMBL147465 | 0.86 | ALDH1A1 (1.00) | ALDH1A1SMN1; SMN2SRD5A2TP53TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022025636-A1 | DUAL REGULATOR FOR MGLUR5 AND 5-HT2A RECEPTORS AND USE THEREOF | 주식회사 비보존 | 2022-02-03 | — | — | WO | disclosed |
| US-20180093251-A1 | POROUS COORDINATION POLYMER AND GAS STORAGE USING THE SAME | PANASONIC INTELLECTUAL PROPERTY MANAGEMENT CO., LTD. (JP) | 2018-04-05 | — | — | US | disclosed |
| US-20100190766-A1 | ANTIBACTERIAL AGENTS | ACHAOGEN, INC. (US) | 2010-07-29 | — | — | 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-20100190766-A1 | ANTIBACTERIAL AGENTS | MRPL21, SI, ABCB11 | ALDH1A1 687/4885SMN1; SMN2 2202/4885SRD5A2 609/4885 |
“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.