SCHEMBL2683569

SCHEMBL2683569

COCCCN1CCOc2ccc(CO[C@H]3CN(S(=O)(=O)c4ccc(C)cc4)C[C@@H](O)[C@@H]3c3ccc(COCC4CC4)cc3)cc21

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.36
KMT2A Q03164 3/20 0.35
LMNA P02545 6/20 0.35
SMN1; SMN2 Q16637 5/20 0.35
CYP2C9 P11712 1/20 0.35
ALDH1A1 P00352 4/20 0.34
PKM P14618 4/20 0.34
GAA P10253 3/20 0.34
HTT P42858 1/20 0.33
REN P00797 1/20 0.33
MAPT P10636 3/20 0.33
THRB P10828 1/20 0.33
ATM Q13315 1/20 0.33
MEN1 O00255 1/20 0.32

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
SCHEMBL2682373 0.95 LMNA (0.38) POLBKMT2ALMNASMN1; SMN2CYP2C9
SCHEMBL2685034 0.94 LMNA (0.36) POLBKMT2ALMNASMN1; SMN2CYP2C9
SCHEMBL5276185 0.94 LMNA (0.38) POLBKMT2ALMNASMN1; SMN2CYP2C9
SCHEMBL2683091 0.94 LMNA (0.38) POLBKMT2ALMNASMN1; SMN2CYP2C9
SCHEMBL2683488 0.93 KMT2A (0.38) POLBKMT2ALMNASMN1; SMN2CYP2C9
SCHEMBL2683572 0.93 KMT2A (0.38) POLBKMT2ALMNASMN1; SMN2CYP2C9
SCHEMBL5291687 0.93 KMT2A (0.38) POLBKMT2ALMNASMN1; SMN2CYP2C9
SCHEMBL2683875 0.93 KMT2A (0.35) POLBKMT2ALMNASMN1; SMN2CYP2C9
SCHEMBL2682449 0.93 KMT2A (0.35) POLBKMT2ALMNASMN1; SMN2CYP2C9
SCHEMBL2682447 0.93 KMT2A (0.35) POLBKMT2ALMNASMN1; SMN2CYP2C9

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-20120115859-A1 3,4,5-SUBSTITUTED PIPERIDINES AS RENIN INHIBITORS HEROLD PETER (CH) 2012-05-10 US disclosed
US-20090270380-A1 3,4,5-Substituted Piperidines as Renin Inhibitors NOVARTIS AG (CH) 2009-10-29 US disclosed
EP-1863763-A1 3,4,5-SUBSTITUTED PIPERIDINES AS RENIN INHIBITORS Speedel Experimenta AG (CH) 2007-12-12 EP disclosed
EP-1816122-A2 3,4,5-substituted piperidines as therapeutic compounds Speedel Experimenta AG (CH) 2007-08-08 EP disclosed
US-20070167433-A1 3,4,5-Substituted piperidines as therapeutic compounds SPEEDEL EXPERIMENTA AG (CH) 2007-07-19 US disclosed
WO-2006103275-A1 3,4,5-SUBSTITUTED PIPERIDINES AS RENIN INHIBITORS SPEEDEL EXPERIMENTA AG (CH) 2006-10-05 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 (3 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-20070167433-A1 3,4,5-Substituted piperidines as therapeutic compounds CTSD, CTSL, CTSZ POLB 1719/4885KMT2A 3247/4885LMNA 390/4885
US-20120115859-A1 3,4,5-SUBSTITUTED PIPERIDINES AS RENIN INHIBITORS REN, AGTR1, AGTR2 POLB 2849/4885KMT2A 3806/4885LMNA 536/4885
US-20090270380-A1 3,4,5-Substituted Piperidines as Renin Inhibitors REN, AGTR1, AGTR2 POLB 2892/4885KMT2A 3683/4885LMNA 508/4885

“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.