Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 6/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | CNR1 | P21554 | 5/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.50 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.48 |
| ▸ | 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 | 0.91 | POLB (0.56) | MCHR1POLBCNR1CYP2D6CHRM1 | |
| SCHEMBL11165531 | 0.90 | MCHR1 (0.55) | MCHR1POLBCNR1CYP2D6CHRM1 | |
| SCHEMBL11165965 | 0.90 | MCHR1 (0.55) | MCHR1POLBCNR1CYP2D6CHRM1 | |
| SCHEMBL10356773 | 0.90 | MCHR1 (0.55) | MCHR1POLBCNR1CYP2D6CHRM1 | |
| SCHEMBL11441498 | 0.89 | MCHR1 (0.56) | MCHR1POLBCNR1CYP2D6CHRM1 | |
| Hydrochloric Acid SCHEMBL11185021 | 0.88 | POLB (0.54) | MCHR1POLBCNR1PTGS2DNMT3A | |
| SCHEMBL11220179 | 0.88 | MCHR1 (0.54) | MCHR1POLBCNR1CYP2D6CHRM1 | |
| SCHEMBL11189302 | 0.87 | POLB (0.52) | MCHR1POLBCNR1CYP2D6CHRM1 | |
| SCHEMBL11441073 | 0.87 | POLB (0.52) | MCHR1POLBCNR1CYP2D6CHRM1 | |
| Hydrochloric Acid SCHEMBL11182793 | 0.87 | POLB (0.52) | MCHR1POLBCNR1CYP2D6CHRM1 |
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-0023569-B1 | DERIVATIVES OF CARBOXYLIC ACIDS, THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM | Dr. Karl Thomae GmbH (DE) | 1983-06-22 | — | — | EP | disclosed |
| EP-0023569-A1 | Derivatives of carboxylic acids, their preparation and medicaments containing them | Dr. Karl Thomae GmbH (DE) | 1981-02-11 | — | — | EP | disclosed |