Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL2785652 | 0.86 | MCL1 (0.40) | MCL1LMNAALDH1A1TDP1ATM | |
| SCHEMBL30006426 | 0.78 | TDP1 (0.39) | ALDH1A1TDP1 | |
| SCHEMBL8183232 | 0.77 | ALDH1A1 (0.45) | MCL1LMNAALDH1A1TDP1ATM | |
| SCHEMBL13177073 | 0.77 | ALDH1A1 (0.50) | ALDH1A1TDP1 | |
| SCHEMBL14895499 | 0.76 | ECE1 (0.35) | MCL1LMNAALDH1A1ATMMAPT | |
| SCHEMBL13785286 | 0.75 | — | — | |
| SCHEMBL6879131 | 0.75 | — | — | |
| SCHEMBL8564993 | 0.75 | — | — | |
| SCHEMBL28323661 | 0.75 | SLC22A6 (0.38) | ALDH1A1TDP1MAPT | |
| SCHEMBL10117376 | 0.74 | TSHR (0.39) | MCL1LMNAALDH1A1ATMMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-20120088706-A1 | WATER-MIXED METAL WORKING FLUIDS CONTAINING ETHER PYRROLIDONE CARBOXYLIC ACIDS | CLARIANT FINANCE (BVI) LIMITED (VG) | 2012-04-12 | — | — | US | disclosed |
| US-20120040875-A1 | Water-Based Hydraulic Fluids Comprising Dithio-Di(Aryl Carbolic Acids) | CLARIANT FINANCE (BVI) LIMITED (VG) | 2012-02-16 | — | — | US | disclosed |