Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | ZDHHC7 | Q9NXF8 | 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 | |
|---|---|---|---|---|
| SCHEMBL3847765 | 0.81 | TDP1 (0.54) | LMNACHRM1AKR1A1CHRM3HTR2A | |
| SCHEMBL27643509 | 0.79 | GPR84 (0.50) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| Ethyl Acetate SCHEMBL3607362 | 0.78 | ALDH1A1 (0.47) | ALDH1A1LMNAHSD17B10POLB | |
| SCHEMBL27778203 | 0.76 | GPR84 (0.52) | CA2MAPK1GPR84FFAR1ZDHHC7 | |
| SCHEMBL20563203 | 0.76 | GPR84 (0.52) | CA2MAPK1GPR84FFAR1ZDHHC7 | |
| SCHEMBL20564670 | 0.76 | GPR84 (0.52) | CA2MAPK1GPR84FFAR1ZDHHC7 | |
| SCHEMBL30049090 | 0.76 | POLB (0.40) | ALDH1A1LMNAHSD17B10CHRM1AKR1A1 | |
| SCHEMBL8677921 | 0.75 | TDP1 (0.56) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| Hexane SCHEMBL57827 | 0.75 | ALDH1A1 (0.78) | ALDH1A1LMNAHSD17B10MAPTFAAH | |
| Hexane SCHEMBL514605 | 0.75 | ALDH1A1 (0.78) | ALDH1A1LMNAHSD17B10MAPTFAAH |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20170334899-A1 | AMINO-SUBSTITUTED ISOTHIAZOLES | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2017-11-23 | — | — | 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-20170334899-A1 | AMINO-SUBSTITUTED ISOTHIAZOLES | BRCA1, TP53, SULT2A1 | ALDH1A1 197/4885LMNA 3219/4885HSD17B10 2797/4885 |
“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.