SCHEMBL2284094

SCHEMBL2284094

COCCCc1ccc(Cl)c(CN(C(=O)CC#N)C2CC2)c1

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.54
CYP3A4 P08684 4/20 0.54
KCNH2 Q12809 3/20 0.51

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
SCHEMBL2284172 0.78 REN (0.48) RENCYP3A4KCNH2
SCHEMBL2284165 0.78 REN (0.48) RENCYP3A4KCNH2
SCHEMBL3343866 0.76 REN (0.61) RENCYP3A4KCNH2
SCHEMBL2289790 0.74 REN (0.79) RENCYP3A4KCNH2
SCHEMBL2282400 0.73 REN (0.45) RENCYP3A4KCNH2
SCHEMBL2282403 0.73 REN (0.45) RENCYP3A4KCNH2
SCHEMBL2282408 0.73 REN (0.43) RENCYP3A4KCNH2
SCHEMBL2282415 0.73 REN (0.43) RENCYP3A4KCNH2
SCHEMBL3417760 0.72 REN (0.51) RENCYP3A4KCNH2
SCHEMBL662533 0.72 SLC6A4 (0.53) RENCYP3A4KCNH2

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-20110207783-A1 RENIN INHIBITORS MERCK CANADA INC. (CA) 2011-08-25 US disclosed
EP-2188256-A1 RENIN INHIBITORS Merck Frosst Canada Ltd. (CA) 2010-05-26 EP disclosed
WO-2009018662-A9 RENIN INHIBITORS MERCK FROSST CANADA LTD. (CA) 2010-04-08 WO disclosed
WO-2009018662-A1 RENIN INHIBITORS MERCK FROSST CANADA LTD. (CA) 2009-02-12 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 (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-20110207783-A1 RENIN INHIBITORS REN, ACE, AGT REN 1/4885CYP3A4 732/4885KCNH2 1459/4885

“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.