Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 1/20 | 0.60 |
| ▸ | NPC1 | O15118 | 1/20 | 0.60 |
| ▸ | RAB9A | P51151 | 1/20 | 0.60 |
| ▸ | POLB | P06746 | 2/20 | 0.55 |
| ▸ | THRB | P10828 | 1/20 | 0.55 |
| ▸ | RECQL | P46063 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.53 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.53 |
| ▸ | SLC6A9 | P48067 | 6/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL29242224 | 0.84 | POLB (0.56) | CNR2NPC1RAB9APOLBTHRB | |
| SCHEMBL589624 | 0.78 | CHRM1 (0.54) | CNR2NPC1RAB9APOLBCHRM1 | |
| SCHEMBL1326650 | 0.77 | TMEM97 (0.48) | CNR2NPC1RAB9APOLBTHRB | |
| SCHEMBL2129927 | 0.77 | CHRM1 (0.61) | CNR2NPC1RAB9APOLBKDM4E | |
| SCHEMBL5509006 | 0.76 | POLB (0.54) | CNR2NPC1RAB9APOLBTHRB | |
| SCHEMBL13585912 | 0.76 | POLB (0.53) | NPC1RAB9APOLBTHRBRECQL | |
| SCHEMBL13456265 | 0.76 | CNR2 (1.00) | CNR2NPC1RAB9ACHRM1CYP1A2 | |
| SCHEMBL14734915 | 0.75 | CNR2 (0.49) | CNR2NPC1RAB9APOLBKDM4E | |
| SCHEMBL5031842 | 0.75 | KDM4E (0.68) | NPC1RAB9APOLBTHRBRECQL | |
| SCHEMBL4148502 | 0.73 | POLB (0.76) | NPC1POLBTHRBRECQLTDP1 |
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-1893566-B1 | CYCLOHEXANESULFONYL DERIVATIVES AS GLYT1 INHIBITORS TO TREAT SCHIZOPHRENIA | MERCK SHARP & DOHME (GB) | 2013-02-13 | — | — | EP | disclosed |