SCHEMBL4670533

SCHEMBL4670533

COCCCCC1(CNC(=O)[C@H]2C[C@@H](C(=O)OC)CN(C(=O)OC(C)(C)C)C2)c2ccccc2Oc2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
REN P00797 3/20 0.57
NAMPT P43490 1/20 0.35
MAPT P10636 1/20 0.35
PDE4B Q07343 2/20 0.35
USP30 Q70CQ3 2/20 0.33
KDM4E B2RXH2 1/20 0.33
PKM P14618 1/20 0.33
KCNH2 Q12809 1/20 0.32
SCN5A Q14524 1/20 0.32
SCN9A Q15858 1/20 0.32
HSD11B1 P28845 2/20 0.32
STS P08842 1/20 0.32
TACR1 P25103 1/20 0.32
KDM1A O60341 1/20 0.32
IL1B P01584 1/20 0.32
P2RX7 Q99572 1/20 0.32
GABRA5 P31644 1/20 0.31

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL4912885 1.00 REN (0.57) RENNAMPTMAPTPDE4BUSP30
SCHEMBL4912890 1.00 REN (0.57) RENNAMPTMAPTPDE4BUSP30
SCHEMBL4669437 0.94 REN (0.57) RENNAMPTMAPTPDE4BUSP30
SCHEMBL4667631 0.94 REN (0.57) RENNAMPTMAPTPDE4BUSP30
SCHEMBL4669434 0.94 REN (0.57) RENNAMPTMAPTPDE4BUSP30
SCHEMBL8254115 0.93 REN (0.57) RENNAMPTMAPTPDE4BUSP30
SCHEMBL14089231 0.92 REN (0.55) RENKCNH2SCN5ASCN9ASTS
SCHEMBL4916218 0.92 REN (0.55) RENKCNH2SCN5ASCN9ASTS
SCHEMBL4909883 0.92 REN (0.55) RENNAMPTMAPTUSP30KDM4E
SCHEMBL4902242 0.92 REN (0.55) RENNAMPTMAPTUSP30KDM4E

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080194629-A1 3-Mono-and 3,5-Disubstituted Piperidine Derivatives as Renin Inhibitors BAESCHLIN DANIEL KASPAR 2008-08-14 US disclosed
US-20080194629-A1 3-Mono-and 3,5-Disubstituted Piperidine Derivatives as Renin Inhibitors BAESCHLIN DANIEL KASPAR 2008-08-14 US disclosed
US-20080194629-A1 3-Mono-and 3,5-Disubstituted Piperidine Derivatives as Renin Inhibitors BAESCHLIN DANIEL KASPAR 2008-08-14 US disclosed
EP-1879882-A1 3 -M0N0- AND 3 , 5-DISUBSTITUTED PIPERIDINE DERIVATIVES AS RENIN INHIBITORS Novartis AG (CH) 2008-01-23 EP disclosed
WO-2006117183-A1 3 -M0N0- AND 3 , 5-DISUBSTITUTED PIPERIDINE DERIVATIVES AS RENIN INHIBITORS NOVARTIS AG (CH) 2006-11-09 WO disclosed
WO-2006117183-A1 3 -M0N0- AND 3 , 5-DISUBSTITUTED PIPERIDINE DERIVATIVES AS RENIN INHIBITORS NOVARTIS AG (CH) 2006-11-09 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080194629-A1 3-Mono-and 3,5-Disubstituted Piperidine Derivatives as Renin Inhibitors REN, ACE, AGTR1 REN 1/4885NAMPT 2165/4885MAPT 1706/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.