Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 5/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 5/20 | 0.40 |
| ▸ | LCK | P06239 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CDC25A | P30304 | 1/20 | 0.36 |
| ▸ | CDC25B | P30305 | 1/20 | 0.36 |
| ▸ | CDC25C | P30307 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | IDH1 | O75874 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8801436 | 0.82 | PTGS2 (0.36) | NR1H2NR1H3LCK | |
| SCHEMBL2600782 | 0.81 | NR1H2 (0.37) | NR1H2NR1H3LMNAMAPTGAA | |
| SCHEMBL9835835 | 0.80 | NR1H2 (0.56) | NR1H2NR1H3LCKMGLLSMN1; SMN2 | |
| SCHEMBL5073360 | 0.78 | NR1H2 (0.57) | NR1H2NR1H3FAAHMGLL | |
| SCHEMBL10757746 | 0.76 | CASP3 (0.53) | NR1H2NR1H3CA12CA9SMN1; SMN2 | |
| SCHEMBL9835833 | 0.76 | LMNA (0.40) | NR1H2NR1H3LCKCA12CA9 | |
| SCHEMBL7500087 | 0.76 | LMNA (0.43) | NR1H2NR1H3LCKLMNAMAPT | |
| SCHEMBL7496165 | 0.74 | KDM4E (0.53) | NR1H2NR1H3LMNAMAPTGAA | |
| SCHEMBL9836829 | 0.74 | NPC1 (0.49) | NR1H2NR1H3LCKCA12CA9 | |
| SCHEMBL7004036 | 0.73 | LCK (0.42) | NR1H2NR1H3LCKFAAHMGLL |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0811625-B1 | Process for preparing diketopyrrolopyrrole derivatives | CIBA SC HOLDING AG (CH) | 2002-04-17 | — | — | EP | disclosed |
| US-5919945-A | REACTING A 1,4-DIKETOPYRROLOPYRROLE WITH FORMALDEHYDE | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 1999-07-06 | — | — | US | disclosed |
| US-5840907-A | REACTING 1,4-DIKETO-3,6-DIARYLPYRROLOPYRROLE WITH FORMALDEHYDE TO FORM HYDROXYMETHYLATED DERIVATIVE, REACTING WITH PRECURSOR OF ORGANIC RADICAL TO REPLACE HYDROXYL GROUPS OR FORM ETHER LINKAGE | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 1998-11-24 | — | — | US | disclosed |
| EP-0811625-A2 | Process for preparing diketopyrrolopyrrole derivatives | Ciba SC Holding AG (CH) | 1997-12-10 | — | — | EP | disclosed |