Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | SOAT1 | P35610 | 8/20 | 0.31 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.31 |
| ▸ | G6PD | P11413 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.30 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8915133 | 0.73 | ALDH1A1 (0.33) | ALDH1A1GPR84SMN1; SMN2 | |
| SCHEMBL8914820 | 0.71 | ALDH1A1 (0.36) | ALDH1A1GPR84SMN1; SMN2CXCR2 | |
| SCHEMBL15440678 | 0.63 | ALDH1A1 (0.39) | ALDH1A1GPR84SMN1; SMN2CXCR1CXCR2 | |
| SCHEMBL1654430 | 0.62 | ALDH1A1 (0.44) | ALDH1A1SOAT1GPR84SMN1; SMN2CYP1A2 | |
| SCHEMBL11718129 | 0.62 | ALDH1A1 (0.38) | ALDH1A1SOAT1GPR84G6PDSMN1; SMN2 | |
| SCHEMBL11719908 | 0.62 | ALDH1A1 (0.38) | ALDH1A1SOAT1GPR84G6PDSMN1; SMN2 | |
| SCHEMBL16417692 | 0.59 | ALDH1A1 (0.41) | ALDH1A1GPR84SMN1; SMN2CXCR1CXCR2 | |
| SCHEMBL27944290 | 0.58 | CA2 (0.50) | CA2CYP2C9 | |
| SCHEMBL7230903 | 0.57 | ALDH1A1 (0.50) | ALDH1A1SOAT1GPR84SMN1; SMN2CYP2C9 | |
| SCHEMBL8770555 | 0.57 | ALDH1A1 (0.50) | ALDH1A1SOAT1GPR84SMN1; SMN2CYP2C9 |
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-5684165-A | FOR USE IN NONLINEAR OPTICS | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-11-04 | — | — | US | disclosed |
| US-5432286-A | Nonlinear optics | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-07-11 | — | — | US | disclosed |
| EP-0592919-A1 | Substituted thieno[3,2-b]thiophenes and their use | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-04-20 | — | — | EP | disclosed |