Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | CES1 | P23141 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | CTNNB1 | P35222 | 7/20 | 0.48 |
| ▸ | WNT3A | P56704 | 4/20 | 0.48 |
| ▸ | NPC1 | O15118 | 5/20 | 0.46 |
| ▸ | RAB9A | P51151 | 5/20 | 0.46 |
| ▸ | PLOD2 | O00469 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | PLOD3 | O60568 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9709462 | 0.92 | MEN1 (0.42) | MEN1KMT2ASMN1; SMN2HPGDMAPT | |
| SCHEMBL11215650 | 0.79 | ALDH1A1 (0.50) | MEN1KMT2AMAPTKDM4EMAPK1 | |
| SCHEMBL11320077 | 0.76 | CPT1B (0.38) | MEN1KMT2AMAPTMAPK1TDP1 | |
| SCHEMBL9436947 | 0.76 | CTNNB1 (0.41) | HPGDCTNNB1WNT3AALDH1A1 | |
| SCHEMBL2788305 | 0.75 | KDM4E (0.59) | SMN1; SMN2HPGDMAPTKDM4EMAPK1 | |
| SCHEMBL5098817 | 0.74 | NPC1 (0.50) | MEN1KMT2AHPGDMAPTKDM4E | |
| SCHEMBL5944024 | 0.74 | ALDH1A1 (0.33) | MAPTKDM4EMAPK1NPC1RAB9A | |
| SCHEMBL11235233 | 0.74 | HDAC8 (0.42) | MEN1KMT2ASMN1; SMN2HPGDNPC1 | |
| SCHEMBL8961590 | 0.74 | CTNNB1 (0.82) | MEN1KMT2ASMN1; SMN2MAPTKDM4E | |
| SCHEMBL10027735 | 0.74 | CTNNB1 (0.82) | MEN1KMT2ASMN1; SMN2HPGDMAPT |
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-0507013-B1 | Process for the preparation of aromatic beta-diketones | WITCO CORP (US) | 1996-02-07 | — | — | EP | disclosed |
| EP-0507013-A1 | Process for the preparation of aromatic beta-diketones | WITCO CORPORATION (US) | 1992-10-07 | — | — | EP | disclosed |