Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 2/20 | 0.35 |
| ▸ | RORB | Q92753 | 2/20 | 0.35 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | LTB4R2 | Q9NPC1 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HDAC5 | Q9UQL6 | 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 | |
|---|---|---|---|---|
| SCHEMBL2156975 | 0.91 | MEN1 (0.37) | MEN1KMT2ARXFP1DGAT1CYP1A2 | |
| SCHEMBL2156970 | 0.82 | LMNA (0.37) | MEN1KMT2ARXFP1RORCDGAT1 | |
| SCHEMBL2155535 | 0.77 | MAPT (0.38) | MEN1KMT2ARXFP1CYP1A2CYP3A4 | |
| SCHEMBL20357360 | 0.67 | MEN1 (0.44) | MEN1KMT2ACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL4437768 | 0.65 | MEN1 (0.54) | MEN1KMT2ARXFP1CYP1A2CYP3A4 | |
| SCHEMBL2156009 | 0.65 | L3MBTL1 (0.35) | — | |
| SCHEMBL11503905 | 0.64 | CES2 (0.45) | MEN1KMT2ARXFP1CYP1A2CYP3A4 | |
| SCHEMBL1334800 | 0.62 | HDAC1 (0.49) | MEN1KMT2ARORCLTB4R2HDAC1 | |
| SCHEMBL1013242 | 0.62 | CES2 (0.49) | MEN1KMT2ATP53MAPT | |
| SCHEMBL2155960 | 0.61 | ALDH1A1 (0.35) | MEN1KMT2ACYP1A2CYP3A4CYP2C19 |
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-7973072-B2 | Pain, eating disorders, neurodegenerative disorders, memory impairment; attention deficit syndrome, opioid tolerance, drug addiction; (4-oxothiochroman-3,3-diyl)bis(methylene)bis(3-(trifluoromethyl)benzoate for example | GRUENENTHAL GMBH (DE) | 2011-07-05 | — | — | US | claimed |
| US-7973072-B2 | Pain, eating disorders, neurodegenerative disorders, memory impairment; attention deficit syndrome, opioid tolerance, drug addiction; (4-oxothiochroman-3,3-diyl)bis(methylene)bis(3-(trifluoromethyl)benzoate for example | GRUENENTHAL GMBH (DE) | 2011-07-05 | — | — | US | disclosed |