SCHEMBL90715

SCHEMBL90715

CCOC[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@@H](C(=O)N(c2ccc3c(c2)N(CCCOC)C(=O)C(C)(C)O3)C2CC2)CN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
REN P00797 11/20 0.53
KCNH2 Q12809 4/20 0.34
ALDH1A1 P00352 2/20 0.32
YAP1 P46937 1/20 0.31
TSHR P16473 1/20 0.31
CTSL P07711 2/20 0.31
CTSS P25774 2/20 0.31

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
SCHEMBL90292 1.00 REN (0.53) RENKCNH2ALDH1A1YAP1TSHR
SCHEMBL90288 0.96 REN (0.47) RENALDH1A1YAP1TSHR
SCHEMBL90057 0.96 REN (0.47) RENALDH1A1YAP1TSHR
SCHEMBL89914 0.92 REN (0.63) RENKCNH2ALDH1A1
SCHEMBL89824 0.92 REN (0.63) RENKCNH2ALDH1A1
SCHEMBL89902 0.91 REN (0.50) RENKCNH2ALDH1A1
SCHEMBL90253 0.91 REN (0.50) RENKCNH2ALDH1A1
SCHEMBL89874 0.91 REN (0.53) RENKCNH2ALDH1A1
SCHEMBL90630 0.91 REN (0.53) RENKCNH2ALDH1A1
SCHEMBL89823 0.91 REN (0.55) RENKCNH2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8129411-B2 Organic compounds NOVARTIS AG (CH) 2012-03-06 US disclosed
US-8129411-B2 Organic compounds NOVARTIS AG (CH) 2012-03-06 US disclosed
EP-2420491-A1 3 , 5-substitued piperidine compounds as renin inhibitors Novartis AG (CH) 2012-02-22 EP disclosed
US-20090192148-A1 Organic Compounds NOVARTIS AG (CH) 2009-07-30 US disclosed
US-20090192148-A1 Organic Compounds NOVARTIS AG (CH) 2009-07-30 US disclosed
WO-2007077005-A1 3 , 5-SUBSTITΓUED PIPERIDINE COMPOUNDS AS RENIN INHIBITORS NOVARTIS AG (CH) 2007-07-12 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-20090192148-A1 Organic Compounds REN, ACE, AGTR1 REN 1/4885KCNH2 415/4885ALDH1A1 38/4885

“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.