Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.44 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | ACP3 | P15309 | 2/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL28136546 | 0.86 | TSHR (0.50) | CYP3A4ALDH1A1TSHRTAAR1HSD17B10 | |
| SCHEMBL109223 | 0.86 | TSHR (0.50) | CYP3A4ALDH1A1TSHRTAAR1HSD17B10 | |
| SCHEMBL30724553 | 0.84 | TSHR (0.48) | CYP3A4ALDH1A1TSHRTAAR1HSD17B10 | |
| Ethylene SCHEMBL27607233 | 0.84 | TSHR (0.48) | CYP3A4ALDH1A1TSHRTAAR1HSD17B10 | |
| Ammonia Solution, Strong SCHEMBL9691228 | 0.84 | TSHR (0.48) | CYP3A4ALDH1A1TSHRTAAR1HSD17B10 | |
| Hydrochloric Acid SCHEMBL11666238 | 0.84 | TSHR (0.48) | CYP3A4ALDH1A1TSHRTAAR1HSD17B10 | |
| Butadiene SCHEMBL11004598 | 0.82 | TSHR (0.46) | CYP3A4ALDH1A1TSHRTAAR1HSD17B10 | |
| SCHEMBL3791852 | 0.78 | ACP3 (0.44) | CYP3A4CHRNB2CHRNA4CYP1A2ACP3 | |
| 1,1-Dichloroethene SCHEMBL17353950 | 0.78 | TSHR (0.42) | CYP3A4ALDH1A1TSHRMAPK1HSD17B10 | |
| Trimethylammonium SCHEMBL4188940 | 0.78 | TSHR (0.42) | CYP3A4ALDH1A1TSHRHSD17B10TDP1 |
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-7674825-B2 | Dicarboxylic acid derivatives with pharmaceutical properties | BAYER AKTIENGESELLSCHAFT (DE) | 2010-03-09 | — | — | US | disclosed |
| US-20080058314-A1 | Novel dicarboxylic acid derivatives with pharmaceutical properties | BAYER AKTIENGESELLSCHAFT | 2008-03-06 | — | — | 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-20080058314-A1 | Novel dicarboxylic acid derivatives with pharmaceutical properties | PC, GOT2, SDHA | CYP3A4 349/4885CYP17A1 1464/4885CHRNB2 3923/4885 |
“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.