Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19315302 | 0.76 | KDM4E (0.43) | KDM4EALDH1A1HPGDPOLBHSD17B10 | |
| SCHEMBL12697284 | 0.76 | KDM4E (0.40) | KDM4EALDH1A1HPGDPOLBHSD17B10 | |
| SCHEMBL14684126 | 0.72 | KDM4E (0.37) | KDM4EALDH1A1HPGDPOLBHSD17B10 | |
| SCHEMBL9925339 | 0.65 | KDM4E (0.30) | KDM4EALDH1A1HPGDPOLBHSD17B10 | |
| SCHEMBL5056754 | 0.64 | — | — | |
| SCHEMBL15128284 | 0.63 | KDM4E (0.35) | KDM4EALDH1A1HPGDPOLBHSD17B10 | |
| SCHEMBL12334141 | 0.61 | — | — | |
| SCHEMBL15128265 | 0.60 | — | — | |
| SCHEMBL4570765 | 0.60 | KDM4E (0.47) | KDM4EALDH1A1HPGDPOLBHSD17B10 | |
| SCHEMBL8523180 | 0.58 | KDM4E (0.31) | KDM4EALDH1A1HPGDPOLBHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010059773-A1 | ARYL METHYL BENZOQUINAZOLINONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS | MERCK SHARP & DOHME CORP. (US) | 2010-05-27 | — | — | WO | disclosed |
| US-7439385-B2 | Process for the preparation of biphosphonic derivatives | ALEMBIC LIMITED (IN) | 2008-10-21 | — | — | US | disclosed |