Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.60 |
| ▸ | TP53 | P04637 | 1/20 | 0.60 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA3 | P07451 | 1/20 | 0.50 |
| ▸ | TYR | P14679 | 1/20 | 0.50 |
| ▸ | DRD1 | P21728 | 1/20 | 0.50 |
| ▸ | CA4 | P22748 | 1/20 | 0.50 |
| ▸ | CA6 | P23280 | 1/20 | 0.50 |
| ▸ | CA5A | P35218 | 1/20 | 0.50 |
| ▸ | CA7 | P43166 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Terephthalic Acid SCHEMBL28358133 | 0.97 | TSHR (0.63) | TSHRALDH1A1TP53SRD5A2SMN1; SMN2 | |
| SCHEMBL49984 | 0.97 | TSHR (0.63) | TSHRALDH1A1TP53SRD5A2SMN1; SMN2 | |
| Terephthalic Acid SCHEMBL28453225 | 0.97 | TSHR (0.63) | TSHRALDH1A1TP53SRD5A2SMN1; SMN2 | |
| SCHEMBL10570096 | 0.95 | TSHR (0.60) | TSHRALDH1A1TP53SRD5A2SMN1; SMN2 | |
| SCHEMBL15251986 | 0.95 | TSHR (0.60) | TSHRALDH1A1TP53SRD5A2SMN1; SMN2 | |
| SCHEMBL27686277 | 0.91 | ALDH1A1 (0.56) | TSHRALDH1A1TP53SRD5A2SMN1; SMN2 | |
| Cyclopropane SCHEMBL8984335 | 0.91 | ALDH1A1 (0.56) | TSHRALDH1A1TP53SRD5A2SMN1; SMN2 | |
| SCHEMBL3641834 | 0.91 | RARB (0.58) | TSHRALDH1A1TP53SRD5A2KMT2A | |
| Benzoic Acid SCHEMBL5085720 | 0.88 | TSHR (0.67) | TSHRALDH1A1TP53SRD5A2SMN1; SMN2 | |
| Terephthalic Acid SCHEMBL6473290 | 0.87 | ALDH1A1 (0.71) | TSHRALDH1A1TP53SRD5A2SMN1; SMN2 |
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-4447645-A | HYDROGENATION OF 4-CARBOXYLBENZALDEHYDE, SEPARATION, FILTRATION, HYDROCARBON EXTRACTION OF P-TOLUIC ACID, AND CRYSTALLIZATION | STANDARD OIL COMPANY (INDIANA) (US) | 1984-05-08 | — | — | US | disclosed |
| US-4431797-A | ELECTROLYTIC REDUCTION OF TEREPHTHALIC ACID TO AMMONIUM SALT OF P- | STANDARD OIL COMPANY (INDIANA) (US) | 1984-02-14 | — | — | US | disclosed |
| US-4431798-A | CATALYTIC MELT POLYMERIZATION WITH IMPURITIES OF TEREPHTHALIC ACID, P-CARBOXYBENZALDEHYDE AND P-TOLUIC ACID | STANDARD OIL COMPANY (INDIANA) (US) | 1984-02-14 | — | — | US | disclosed |