SCHEMBL4495845

SCHEMBL4495845

N[C@@H]1C[C@H](C(=O)N(Cc2cccc(Cl)c2Cl)C2CC2)CN(C(=O)OCC2c3ccccc3-c3ccccc32)C1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
REN P00797 14/20 0.42
SLC6A4 P31645 5/20 0.40
SLC6A2 P23975 4/20 0.40
KCNH2 Q12809 4/20 0.39
FABP7 O15540 1/20 0.36
FABP5 Q01469 1/20 0.36
SLC6A3 Q01959 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2D6 P10635 1/20 0.36

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
SCHEMBL4495842 1.00 REN (0.42) RENSLC6A4SLC6A2KCNH2FABP7
SCHEMBL4505812 0.94 FABP7 (0.38) RENSLC6A4SLC6A2KCNH2FABP7
SCHEMBL4505814 0.94 FABP7 (0.38) RENSLC6A4SLC6A2KCNH2FABP7
SCHEMBL4504320 0.87 REN (0.35) RENKCNH2CYP3A4
SCHEMBL4504318 0.87 REN (0.35) RENKCNH2CYP3A4
SCHEMBL4495397 0.85 REN (0.61) RENSLC6A4SLC6A2KCNH2
SCHEMBL4495393 0.85 REN (0.61) RENSLC6A4SLC6A2KCNH2
SCHEMBL4503664 0.80 REN (0.45) RENKCNH2CYP3A4
SCHEMBL4503660 0.80 REN (0.45) RENKCNH2CYP3A4
SCHEMBL4498542 0.79 REN (0.53) RENCYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090233920-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-09-17 US disclosed
EP-1907359-A2 3,5-SUBSTITUTED PIPERIDINE DERIVATIVES EFFECTIVE ON RENIN-RELATED DISORDERS Novartis AG (CH) 2008-04-09 EP disclosed
WO-2007006534-A2 PIPERIDINE DERIVATIVES USEFUL IN THE DIAGNOSTIC AND THERAPEUTIC TREATMENT OF DISEASES DEPENDING ON RENIN ACTIVITY NOVARTIS AG (CH) 2007-01-18 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-20090233920-A1 ORGANIC COMPOUNDS REN, ACE, AGTR1 REN 1/4885SLC6A4 586/4885SLC6A2 449/4885

“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.