SCHEMBL2339949

SCHEMBL2339949

CC(C)[Si](OC1CN(C(=O)OCc2ccccc2)CC(O)C1c1ccc(OCCCOc2ccccc2Cl)cc1)(C(C)C)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.40
PPARA Q07869 3/20 0.40
PPARD Q03181 2/20 0.40
REN P00797 2/20 0.35
TP53 P04637 1/20 0.34
MDM2 Q00987 1/20 0.34
TDP1 Q9NUW8 2/20 0.34
MAPT P10636 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
SMN1; SMN2 Q16637 4/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33
LTB4R Q15722 1/20 0.33
LTB4R2 Q9NPC1 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL2364513 0.88 MKNK2 (0.36) REN
SCHEMBL1037741 0.88 NPC1 (0.39) RENSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL4583364 0.87 REN (0.46) REN
SCHEMBL2340534 0.87 REN (0.46) REN
SCHEMBL2339602 0.84 MMP9 (0.43) TP53MDM2SMN1; SMN2NPC1RAB9A
SCHEMBL2340715 0.84 REN (0.39) RENCYP2C19
SCHEMBL4583118 0.83 SMN1; SMN2 (0.40) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL2338938 0.83 SMN1; SMN2 (0.40) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL4583065 0.83 FAAH (0.37) TP53MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL3268191 0.83 FAAH (0.37) TP53MAPTSMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1776359-B1 PIPERIDINE DERIVATIVES AS RENIN INHIBITORS NOVARTIS AG (CH) 2011-08-24 EP disclosed
US-20080076766-A1 Piperidine Derivatives As Renin Inhibitor SPEEDEL EXPERIMENTA AG (CH) 2008-03-27 US 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

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

For each of this compound's patents that has machine-readable text (2 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-20080076766-A1 Piperidine Derivatives As Renin Inhibitor REN, AGTR1, ACE PPARG 3422/4885PPARA 3503/4885PPARD 1255/4885
US-20070167433-A1 3,4,5-Substituted piperidines as therapeutic compounds CTSD, CTSL, CTSZ PPARG 4186/4885PPARA 4317/4885PPARD 1711/4885

“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.