Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | CNR1 | P21554 | 6/20 | 0.52 |
| ▸ | MCHR1 | Q99705 | 5/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11188865 | 0.93 | POLB (0.56) | POLBCNR1MCHR1PTGS2CYP2D6 | |
| SCHEMBL11220179 | 0.90 | MCHR1 (0.54) | POLBCNR1MCHR1PTGS2CYP2D6 | |
| Hydrochloric Acid SCHEMBL11182793 | 0.89 | POLB (0.52) | POLBCNR1MCHR1PTGS2CYP2D6 | |
| SCHEMBL11189302 | 0.89 | POLB (0.52) | POLBCNR1MCHR1PTGS2CYP2D6 | |
| SCHEMBL11191067 | 0.89 | HSD17B10 (0.57) | POLBCNR1MCHR1 | |
| SCHEMBL11191291 | 0.89 | HSD17B10 (0.57) | POLBCNR1MCHR1 | |
| SCHEMBL11165965 | 0.88 | MCHR1 (0.55) | POLBCNR1MCHR1PTGS2CYP2D6 | |
| SCHEMBL11165531 | 0.88 | MCHR1 (0.55) | POLBCNR1MCHR1PTGS2CYP2D6 | |
| SCHEMBL11194063 | 0.88 | POLB (0.52) | POLBCNR1MCHR1PTGS2CYP2D6 | |
| Hydrochloric Acid SCHEMBL11185021 | 0.88 | POLB (0.54) | POLBCNR1MCHR1PTGS2DNMT3A |
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-0023569-A1 | Derivatives of carboxylic acids, their preparation and medicaments containing them | Dr. Karl Thomae GmbH (DE) | 1981-02-11 | — | — | EP | disclosed |