SCHEMBL4902246

SCHEMBL4902246

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

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
REN P00797 4/20 0.55
USP30 Q70CQ3 3/20 0.34
NAMPT P43490 1/20 0.34
KMT2A Q03164 1/20 0.34
GPR119 Q8TDV5 2/20 0.33
MAPT P10636 1/20 0.32
KDM4E B2RXH2 1/20 0.32
PKM P14618 1/20 0.32
IL1B P01584 1/20 0.32
P2RX7 Q99572 1/20 0.32
MAPK8 P45983 1/20 0.31
KCNH2 Q12809 1/20 0.31
SCN5A Q14524 1/20 0.31
SCN9A Q15858 1/20 0.31
HSD11B1 P28845 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 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
SCHEMBL4903306 1.00 REN (0.55) RENUSP30NAMPTKMT2AGPR119
SCHEMBL4902242 1.00 REN (0.55) RENUSP30NAMPTKMT2AGPR119
SCHEMBL4910052 0.93 REN (0.54) RENUSP30NAMPTKMT2AMAPT
SCHEMBL4910054 0.93 REN (0.54) RENUSP30NAMPTKMT2AMAPT
SCHEMBL4910192 0.93 REN (0.54) RENUSP30NAMPTKMT2AMAPT
SCHEMBL4669437 0.92 REN (0.57) RENUSP30NAMPTMAPTKDM4E
SCHEMBL4667631 0.92 REN (0.57) RENUSP30NAMPTMAPTKDM4E
SCHEMBL4912885 0.92 REN (0.57) RENUSP30NAMPTMAPTKDM4E
SCHEMBL4669434 0.92 REN (0.57) RENUSP30NAMPTMAPTKDM4E
SCHEMBL4912890 0.92 REN (0.57) RENUSP30NAMPTMAPTKDM4E

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 1/4885USP30 2082/4885NAMPT 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.