Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.39 |
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 5/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | STAT3 | P40763 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.36 |
| ▸ | ACR | P10323 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8779241 | 0.96 | LMNA (0.40) | SMN1; SMN2LMNACYP1A2NPC1CYP2D6 | |
| SCHEMBL8779257 | 0.95 | LMNA (0.41) | SMN1; SMN2LMNACYP1A2NPC1CYP2D6 | |
| SCHEMBL8779273 | 0.94 | IKBKB (0.38) | SMN1; SMN2LMNACYP1A2NPC1CYP2D6 | |
| SCHEMBL8779277 | 0.90 | SMN1; SMN2 (0.35) | SMN1; SMN2LMNAKMT2AKDM4E | |
| SCHEMBL8779087 | 0.89 | IKBKB (0.34) | SMN1; SMN2LMNASTAT3KMT2AKDM4E | |
| SCHEMBL8779326 | 0.89 | SMN1; SMN2 (0.39) | SMN1; SMN2LMNAKMT2AHPGD | |
| SCHEMBL8785157 | 0.86 | FAAH (0.38) | SMN1; SMN2LMNACYP1A2NPC1CYP2D6 | |
| SCHEMBL8779253 | 0.86 | HTT (0.39) | KDM4EHDAC10HDAC6 | |
| SCHEMBL8779250 | 0.85 | MEN1 (0.42) | SMN1; SMN2LMNACYP1A2NPC1CYP2C9 | |
| SCHEMBL8785223 | 0.84 | FAAH (0.43) | SMN1; SMN2LMNACYP1A2NPC1CYP2D6 |
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-0661269-B1 | Substituted heterocyclic carboxylic acid amides, their preparation and their use as medicaments | HOECHST AG (DE) | 1997-03-26 | — | — | EP | disclosed |
| EP-0661269-A1 | Substituted heterocyclic carboxylic acid amides, their preparation and their use as medicaments | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-07-05 | — | — | EP | disclosed |