Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | THPO | P40225 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11186297 | 0.98 | KDM4E (0.41) | KDM4ELMNATSHRCHRM2CHRM4 | |
| SCHEMBL11271773 | 0.91 | PTGS2 (0.46) | KDM4ELMNATSHRCHRM2CHRM4 | |
| SCHEMBL11269384 | 0.89 | PTGS2 (0.46) | KDM4ELMNATSHRCHRM2CHRM4 | |
| SCHEMBL11171928 | 0.89 | PTGS1 (0.39) | KDM4ELMNACHRM1PTGS2PTGS1 | |
| SCHEMBL11274442 | 0.87 | PTGS2 (0.50) | KDM4ELMNATSHRPTGS2PTGS1 | |
| SCHEMBL11178933 | 0.87 | MEN1 (0.36) | KDM4ELMNATSHRCHRM2CHRM4 | |
| SCHEMBL11200223 | 0.87 | MEN1 (0.36) | KDM4ELMNATSHRCHRM2CHRM4 | |
| SCHEMBL11189127 | 0.86 | MEN1 (0.36) | KDM4ELMNATSHRCHRM2CHRM4 | |
| SCHEMBL11180792 | 0.86 | MEN1 (0.36) | KDM4ELMNATSHRCHRM2CHRM4 | |
| SCHEMBL11180351 | 0.86 | KDM4E (0.38) | KDM4ELMNATSHRPTGS2PTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0024282-B1 | BENZOYL DERIVATIVES, THEIR PREPARATION AND THEIR USE AS MEDICINES | Dr. Karl Thomae GmbH (DE) | 1983-05-18 | — | — | EP | disclosed |