SCHEMBL1751716

SCHEMBL1751716

Cc1cc(Cl)c(OCCOc2ccc(C3=CCN(C(=O)OC(C)(C)C)CC3C(=O)O)cc2)c(Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
REN P00797 6/20 0.38
GPR119 Q8TDV5 6/20 0.36
TNK2 Q07912 1/20 0.35
CYP3A4 P08684 1/20 0.35
NR1H2 P55055 1/20 0.35

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
SCHEMBL1752248 0.89 GPR119 (0.38) RENGPR119
SCHEMBL12750489 0.79 REN (0.36) RENGPR119CYP3A4
SCHEMBL1751975 0.76 CYP3A4 (0.42) RENGPR119CYP3A4NR1H2
SCHEMBL556513 0.75 KCNH2 (0.47) RENGPR119CYP3A4
SCHEMBL3264631 0.75 KCNH2 (0.47) RENGPR119CYP3A4
SCHEMBL3264633 0.75 KCNH2 (0.47) RENGPR119CYP3A4
SCHEMBL4785830 0.75 REN (0.36) RENGPR119CYP3A4NR1H2
SCHEMBL5668307 0.75 REN (0.41) RENGPR119CYP3A4
SCHEMBL5668304 0.75 REN (0.41) RENGPR119CYP3A4
SCHEMBL1752405 0.75 REN (0.41) RENGPR119CYP3A4

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-7968720-B2 Secondary amines as renin inhibitors ACTELION PHARMACEUTICALS LTD. (CH) 2011-06-28 US disclosed
US-20090176823-A1 Secondary Amines as Renin Inhibitors ACTELION PHARMACEUTICALS LTD. (CH) 2009-07-09 US disclosed
EP-1981847-A1 SECONDARY AMINES AS RENIN INHIBITORS Actelion Pharmaceuticals Ltd. (CH) 2008-10-22 EP disclosed
WO-2007088514-A1 SECONDARY AMINES AS RENIN INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2007-08-09 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-20090176823-A1 Secondary Amines as Renin Inhibitors REN, ACE, AGTR1 REN 1/4885GPR119 353/4885TNK2 2383/4885

“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.