Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 3/20 | 0.40 |
| ▸ | ANPEP | P15144 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | DNTT | P04053 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9730177 | 0.80 | ALDH1A1 (0.46) | CYP1A2HIF1AALDH1A1BRD4MMP2 | |
| SCHEMBL9636564 | 0.78 | ALDH1A1 (0.44) | CYP1A2ALDH1A1KMT2AKDM4E | |
| SCHEMBL11359734 | 0.77 | CYP1A2 (0.52) | CYP1A2HIF1AALDH1A1BRD4MMP2 | |
| SCHEMBL9729217 | 0.77 | CYP1A2 (0.52) | CYP1A2HIF1AALDH1A1BRD4MMP2 | |
| SCHEMBL11359745 | 0.77 | CYP1A2 (0.52) | CYP1A2HIF1AALDH1A1BRD4MMP2 | |
| SCHEMBL9636452 | 0.76 | ALDH1A1 (0.40) | CYP1A2HIF1AALDH1A1BRD4MMP2 | |
| SCHEMBL9729462 | 0.76 | ALDH1A1 (0.40) | CYP1A2HIF1AALDH1A1BRD4MMP2 | |
| SCHEMBL994649 | 0.75 | BRD4 (0.44) | CYP1A2HIF1AALDH1A1BRD4MMP2 | |
| SCHEMBL7858138 | 0.75 | BRD4 (0.44) | CYP1A2HIF1AALDH1A1BRD4MMP2 | |
| SCHEMBL2372196 | 0.75 | BRD4 (0.44) | CYP1A2HIF1AALDH1A1BRD4MMP2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0272202-B1 | Process for the preparation of optically active bicyclo[3.3.0]octanedione-carboxylic-acid esters | SCHERING AKTIENGESELLSCHAFT (DE) | 1992-07-01 | — | — | EP | disclosed |
| US-5093250-A | Process for producing optically active bicyclo[3.3.0]octanedione carboxylic acid esters | SCHERING AKTIENGESELLSCHAFT (DE) | 1992-03-03 | — | — | US | disclosed |
| US-4912251-A | Process for manufacturing symmetrical diesters of bicyclo[3.3.0]-octanedione dicarboxylic acid | SCHERING AKTIENGESELLSCHAFT (DE) | 1990-03-27 | — | — | US | disclosed |
| EP-0272202-A1 | Process for the preparation of optically active bicyclo[3.3.0]octanedione-carboxylic-acid esters | SCHERING AKTIENGESELLSCHAFT (DE) | 1988-06-22 | — | — | EP | disclosed |
| WO-1988003569-A1 | PROCESS FOR PRODUCING OPTICALLY ACTIVE BICYCLO[3.3.0]OCTANDIONE CARBOXYLIC ACID ESTERS | SCHERING AKTIENGESELLSCHAFT (DE) | 1988-05-19 | — | — | WO | disclosed |