SCHEMBL3268517

SCHEMBL3268517

COCCCN1CCOc2ccc(COC3CN(C(=O)OCc4ccccc4)CC(O[Si](C(C)C)(C(C)C)C(C)C)C3c3ccc(Oc4ccccc4)cc3)cc21

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
REN P00797 3/20 0.34
RIPK1 Q13546 2/20 0.32
GRM5 P41594 1/20 0.32
BMP1 P13497 1/20 0.31
RORC P51449 4/20 0.31
CTSK P43235 1/20 0.31
TMEM97 Q5BJF2 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
BCL9 O00512 1/20 0.30
CTNNB1 P35222 1/20 0.30
PDE4B Q07343 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
SCHEMBL1037107 0.97 REN (0.36) RENRIPK1GRM5BMP1RORC
SCHEMBL3268900 0.96 REN (0.32) RENBMP1RORCCTSK
SCHEMBL2338242 0.96 BMP1 (0.35) RENGRM5BMP1BCL9CTNNB1
SCHEMBL3269224 0.95 UTS2R (0.34) RENRIPK1BCL9CTNNB1
SCHEMBL3267629 0.95 REN (0.32) RENBMP1RORC
SCHEMBL1037839 0.95 REN (0.36) RENGRM5BMP1RORC
SCHEMBL4582802 0.94 REN (0.35) RENGRM5BMP1TMEM97SIGMAR1
SCHEMBL3272138 0.94 REN (0.35) RENGRM5BMP1TMEM97SIGMAR1
SCHEMBL3274090 0.94 BMP1 (0.31) RENRIPK1BMP1RORC
SCHEMBL2340320 0.94 REN (0.35) RENGRM5TMEM97SIGMAR1PDE4B

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
US-7799779-B2 Substituted piperidines as renin inhibitors NOVARTIS AG (CH) 2010-09-21 US disclosed
EP-1863802-B1 SUBSTITUTED PIPERIDINES AS RENIN INHIBITORS NOVARTIS AG (CH) 2010-06-16 EP disclosed
US-20090306064-A1 Substituted Piperidines as Renin Inhibitors NOVARTIS AG (CH) 2009-12-10 US disclosed
EP-1987834-A2 Substituted piperidines as therapeutic compounds Speedel Experimenta AG (CH) 2008-11-05 EP 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-20090306064-A1 Substituted Piperidines as Renin Inhibitors REN, AGTR1, ACE REN 1/4885RIPK1 4628/4885GRM5 1532/4885

“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.