SCHEMBL89208

SCHEMBL89208

COCCCOc1cc(CN(C(=O)[C@@H]2C[C@H](C(=O)NC3(c4ccccc4)CCCC3)CN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OC)c1C

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
REN P00797 8/20 0.41
PDE4B Q07343 1/20 0.38
LPAR1 Q92633 5/20 0.36
CYP3A4 P08684 1/20 0.36
KCNH2 Q12809 1/20 0.36
SCN9A Q15858 1/20 0.34
SLC6A9 P48067 1/20 0.33
TACR1 P25103 1/20 0.33
NR1H4 Q96RI1 1/20 0.33

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
SCHEMBL8235131 0.90 REN (0.42) RENPDE4BCYP3A4KCNH2
SCHEMBL90641 0.90 REN (0.42) RENPDE4BCYP3A4KCNH2
SCHEMBL89571 0.87 REN (0.36) RENPDE4BCYP3A4KCNH2SCN9A
SCHEMBL90113 0.85 REN (0.52) RENLPAR1CYP3A4KCNH2
SCHEMBL8235595 0.85 REN (0.52) RENLPAR1CYP3A4KCNH2
SCHEMBL8238508 0.85 REN (0.42) RENPDE4BTACR1
SCHEMBL90034 0.85 REN (0.42) RENPDE4BTACR1
SCHEMBL89702 0.85 REN (0.47) RENPDE4BCYP3A4KCNH2TACR1
SCHEMBL89577 0.85 REN (0.35) RENPDE4B
SCHEMBL89707 0.84 REN (0.47) RENPDE4BTACR1NR1H4

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
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
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 1/4885PDE4B 904/4885LPAR1 3145/4885

“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.