Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GRN | P28799 | 1/20 | 0.33 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.33 |
| ▸ | F10 | P00742 | 1/20 | 0.32 |
| ▸ | BRAF | P15056 | 1/20 | 0.31 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | AURKA | O14965 | 1/20 | 0.30 |
| ▸ | CSF1R | P07333 | 1/20 | 0.30 |
| ▸ | RET | P07949 | 1/20 | 0.30 |
| ▸ | LTK | P29376 | 1/20 | 0.30 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.30 |
| ▸ | CDK8 | P49336 | 1/20 | 0.30 |
| ▸ | CLK2 | P49760 | 1/20 | 0.30 |
| ▸ | CDK5 | Q00535 | 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 | |
|---|---|---|---|---|
| SCHEMBL12474102 | 0.77 | KDM4E (0.41) | KDM4EGRNSORT1KMT2AALDH1A1 | |
| SCHEMBL15149755 | 0.76 | NOS1 (0.38) | SMN1; SMN2LMNAGAAKDM4EGRN | |
| SCHEMBL2338097 | 0.76 | SMN1; SMN2 (0.46) | SMN1; SMN2LMNAGAAKDM4EGRN | |
| SCHEMBL14800091 | 0.76 | GAA (0.38) | SMN1; SMN2LMNAGAAKDM4EGRN | |
| Hydrochloric Acid SCHEMBL5754005 | 0.74 | SMN1; SMN2 (0.44) | SMN1; SMN2LMNAGAAKDM4EGRN | |
| Hydrochloric Acid SCHEMBL4035308 | 0.74 | SMN1; SMN2 (0.44) | SMN1; SMN2LMNAGAAKDM4EGRN | |
| SCHEMBL25297789 | 0.73 | GAA (0.36) | SMN1; SMN2LMNAGAAKDM4EGRN | |
| SCHEMBL18529322 | 0.72 | ESRRA (0.45) | BRAFMAPK3MAPK1 | |
| SCHEMBL27637077 | 0.71 | SMN1; SMN2 (0.48) | SMN1; SMN2LMNAGAAKDM4EGRN | |
| SCHEMBL11982018 | 0.69 | SMN1; SMN2 (0.39) | SMN1; SMN2LMNAGAAKDM4EGRN |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101321525-B | Heteroaryl substituted piperidine derivatives as L-CPT1 inhibitors | HOFFMANN LA ROCHE | 2013-01-30 | — | — | CN | disclosed |
| EP-1959951-B1 | HETEROARYL SUBSTITUTED PIPERIDINE DERIVATIVES AS L-CPT1 INHIBITORS | HOFFMANN LA ROCHE (CH) | 2009-12-23 | — | — | EP | disclosed |
| CN-101321525-A | Heteroaryl substituted piperidine derivatives as L-CPT1 inhibitors | HOFFMANN LA ROCHE (CH) | 2008-12-10 | — | — | CN | disclosed |