SCHEMBL4911713

SCHEMBL4911713

CCN(CC(C)(C)CN(C)C)C(=O)[C@@H]1C[C@H](C(=O)NCC2(CCCCOC)c3ccccc3Oc3ccccc32)CN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
REN P00797 3/20 0.51
MAPT P10636 1/20 0.32
NAMPT P43490 1/20 0.32
POLB P06746 1/20 0.31
USP30 Q70CQ3 2/20 0.31
GPR119 Q8TDV5 1/20 0.30
KDM4E B2RXH2 1/20 0.30
PKM P14618 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL8258904 1.00 REN (0.51) RENMAPTNAMPTPOLBUSP30
SCHEMBL14089255 0.93 REN (0.51) RENMAPTNAMPT
SCHEMBL4913315 0.93 REN (0.51) RENMAPTNAMPT
SCHEMBL4911709 0.91 REN (0.50) RENMAPTGPR119KDM4E
SCHEMBL14089235 0.91 REN (0.50) RENMAPTGPR119KDM4E
SCHEMBL4913977 0.89 REN (0.50) RENMAPTNAMPTUSP30GPR119
SCHEMBL14089236 0.89 REN (0.50) RENMAPTNAMPTUSP30GPR119
SCHEMBL4912889 0.89 REN (0.49) RENMAPTNAMPTUSP30
SCHEMBL4913212 0.89 REN (0.51) RENMAPTNAMPT
SCHEMBL4913717 0.89 REN (0.53) RENMAPTNAMPTKDM4EPKM

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.

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

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 1/4885MAPT 1706/4885NAMPT 2165/4885

“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.