Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | PTGIR | P43119 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | PRSS1 | P07477 | 4/20 | 0.36 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.36 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5657607 | 0.81 | KMT2A (0.41) | SMN1; SMN2IDO1MEN1KMT2AALDH1A1 | |
| SCHEMBL7167511 | 0.77 | PRSS1 (0.42) | SMN1; SMN2MEN1KMT2APRSS1PRSS2 | |
| SCHEMBL7444492 | 0.75 | KLK1 (0.55) | PRSS1PRSS2PRSS3F2TMPRSS6 | |
| SCHEMBL15624790 | 0.68 | PRSS1 (0.50) | PTGIRPRSS1PRSS2PRSS3ALDH1A1 | |
| SCHEMBL952297 | 0.66 | — | — | |
| SCHEMBL23565998 | 0.66 | PRSS1 (0.44) | SMN1; SMN2IDO1PTGIRMEN1KMT2A | |
| SCHEMBL19486513 | 0.65 | CA12 (0.49) | PTGIRPRSS1PRSS2PRSS3F2 | |
| Hydrochloric Acid SCHEMBL23541192 | 0.65 | PRSS1 (0.43) | SMN1; SMN2IDO1PTGIRMEN1KMT2A | |
| SCHEMBL5653814 | 0.65 | TLR8 (0.39) | MEN1KMT2AALDH1A1RAB9ANPC1 | |
| SCHEMBL7448690 | 0.65 | KDM4E (0.43) | MEN1KMT2APRSS1PRSS2PRSS3 |
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-0966454-A1 | DISUBSTITUTED BICYCLIC HETEROCYCLES, THEIR PRODUCTION AND USE AS MEDICAMENTS | Boehringer Ingelheim Pharma KG (DE) | 1999-12-29 | — | — | EP | disclosed |
| WO-1998037075-A1 | DISUBSTITUTED BICYCLIC HETEROCYCLES, THEIR PRODUCTION AND USE AS MEDICAMENTS | BOEHRINGER INGELHEIM PHARMA KG (DE) | 1998-08-27 | — | — | WO | disclosed |