Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 5/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.35 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7713557 | 0.76 | ALOX5 (0.40) | LMNACYP2D6MAPK1CYP2C19MEN1 | |
| SCHEMBL822958 | 0.66 | MAPT (0.34) | LMNACYP2C19SMN1; SMN2TP53ALDH1A1 | |
| SCHEMBL27769039 | 0.65 | SMN1; SMN2 (0.42) | TSHRCYP1A2CYP2D6SMN1; SMN2MEN1 | |
| SCHEMBL10427132 | 0.65 | SMN1; SMN2 (0.36) | LMNASMN1; SMN2MEN1KMT2ATP53 | |
| SCHEMBL12981791 | 0.64 | — | — | |
| Cyclohexanone SCHEMBL28101606 | 0.64 | TRIM24 (0.48) | TSHRMAPK1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL27790502 | 0.64 | SMN1; SMN2 (0.41) | TSHRCYP1A2CYP2D6SMN1; SMN2MEN1 | |
| Cyclohexanone SCHEMBL28833899 | 0.62 | TRIM24 (0.46) | TSHRSMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL24924990 | 0.61 | CDC25A (0.36) | ESR1TSHRLMNACYP1A2CYP2D6 | |
| Butoxyethanol SCHEMBL23121479 | 0.61 | TSHR (0.61) | TSHRLMNAMAPK1SMN1; SMN2MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0270002-B1 | CYCLOHEXENONE DERIVATIVES | BASF Aktiengesellschaft (DE) | 1992-04-15 | — | — | EP | disclosed |
| EP-0270002-A2 | Cyclohexenone derivatives | BASF Aktiengesellschaft (DE) | 1988-06-08 | — | — | EP | disclosed |