SCHEMBL1082279

SCHEMBL1082279

Cn1ccc([C@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2C(=O)N(Cc2cc(Br)cc(C(=O)c3ccccc3)c2)C2CC2)cc1=O

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
REN P00797 17/20 0.50
KCNH2 Q12809 12/20 0.50
CYP3A4 P08684 1/20 0.44
TACR1 P25103 2/20 0.42
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38

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
SCHEMBL1082277 1.00 REN (0.50) RENKCNH2CYP3A4TACR1JAK2
SCHEMBL1073154 0.91 REN (0.52) RENKCNH2CYP3A4
SCHEMBL1072655 0.88 REN (0.53) RENKCNH2CYP3A4TACR1
SCHEMBL1072653 0.88 REN (0.53) RENKCNH2CYP3A4TACR1
SCHEMBL1070602 0.86 REN (0.68) RENKCNH2CYP3A4
SCHEMBL1070601 0.86 REN (0.68) RENKCNH2CYP3A4
SCHEMBL1518469 0.84 REN (0.51) RENKCNH2CYP3A4TACR1
SCHEMBL1518466 0.84 REN (0.51) RENKCNH2CYP3A4TACR1
SCHEMBL1518704 0.83 REN (0.52) RENKCNH2CYP3A4
SCHEMBL1518705 0.83 REN (0.52) RENKCNH2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2274295-B1 3, 4 - SUBSTITUTED PIPERIDINE DERIVATIVES AS RENIN INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2015-08-05 EP disclosed
US-8889714-B2 3,4-substituted piperidine derivatives as renin inhibitors ACTELION PHARMACEUTICALS LTD. (CH) 2014-11-18 US disclosed
US-20110053940-A1 3,4-SUBSTITUTED PIPERIDINE DERIVATIVES AS RENIN INHIBITORS IDORSIA PHARMACEUTICALS LTD (CH) 2011-03-03 US disclosed
EP-2274295-A1 3, 4 - SUBSTITUTED PIPERIDINE DERIVATIVES AS RENIN INHIBITORS Merck Frosst Canada Ltd. (CA) 2011-01-19 EP disclosed
WO-2009135299-A1 3, 4 - SUBSTITUTED PIPERIDINE DERIVATIVES AS RENIN INHIBITORS MERCK FROSST CANADA LTD. (CA) 2009-11-12 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-20110053940-A1 3,4-SUBSTITUTED PIPERIDINE DERIVATIVES AS RENIN INHIBITORS REN, ACE, ACE2 REN 1/4885KCNH2 320/4885CYP3A4 99/4885

“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.