SCHEMBL7343601

SCHEMBL7343601

COCCCOc1cc(C[C@@H](C[C@H](NC(=O)OCc2ccccc2)[C@@H]2C[C@@H](C(C)C)C(=O)O2)C(C)C)ccc1OC

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.47
CYP3A4 P08684 1/20 0.44

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
SCHEMBL9928632 1.00 REN (0.47) RENCYP3A4
SCHEMBL14788400 1.00 REN (0.47) RENCYP3A4
SCHEMBL14791593 0.90 REN (0.48) REN
SCHEMBL16511409 0.90 REN (0.48) REN
SCHEMBL14655570 0.90 REN (0.48) REN
SCHEMBL4048454 0.90 REN (0.48) REN
SCHEMBL12503115 0.90 REN (0.48) REN
SCHEMBL16020531 0.89 REN (0.49) REN
SCHEMBL9907059 0.88 REN (0.46) REN
SCHEMBL1931894 0.88 REN (0.46) REN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0678503-B1 Delta-amino-gamma-hydroxy-omega-aryl alkanoic acid amides with enzyme especially renin inhibiting activities NOVARTIS AG (CH) 1999-09-01 EP claimed
US-5654445-A INTERMEDIATES FOR RENIN INHIBITORS, HYPOTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1997-08-05 US claimed
US-9346745-B2 Process for producing Aliskiren CHEMO IBERICA, S.A. (ES) 2016-05-24 US disclosed
EP-2736875-B1 CHEMICAL PROCESS FOR OPENING RING COMPOUNDS CHEMO IBÉRICA S A (ES) 2015-07-22 EP disclosed
US-9067868-B2 Chemical process for opening ring compounds CHEMO IBERICA, S.A. (ES) 2015-06-30 US disclosed
US-9067868-B2 Chemical process for opening ring compounds CHEMO IBERICA, S.A. (ES) 2015-06-30 US disclosed
EP-2546243-B1 METHOD FOR PREPARING ALISKIREN ZHEJIANG TIANYU PHARMACEUTICAL CO LTD (CN) 2015-01-07 EP disclosed
US-20140213821-A1 CHEMICAL PROCESS FOR OPENING RING COMPOUNDS CHEMO IBERICA, S. A. (ES) 2014-07-31 US disclosed
US-20140213821-A1 CHEMICAL PROCESS FOR OPENING RING COMPOUNDS CHEMO IBERICA, S. A. (ES) 2014-07-31 US disclosed
US-8664440-B2 Method for preparing aliskiren and its intermediates thereof ZHEJIANG TIANYU PHARMACEUTICAL CO., LTD (CN) 2014-03-04 US disclosed
US-20130225841-A1 METHOD FOR PREPARING ALISKIREN AND ITS INTERMEDIATES THEREOF ZHEJIANG TIANYU PHARMACEUTICAL CO., LTD. (CN) 2013-08-29 US disclosed
WO-2013014191-A1 CHEMICAL PROCESS FOR OPENING RING COMPOUNDS CHEMO IBERICA, S. A. (ES) 2013-01-31 WO disclosed
EP-2551260-A1 Chemical process for opening ring compounds Chemo Ibérica, S.A. (ES) 2013-01-30 EP disclosed
EP-2546243-A1 METHOD FOR PREPARING ALISKIREN AND INTERMEDIATE THEREOF Zhejiang Tianyu Pharmaceutical Co., Ltd (CN) 2013-01-16 EP disclosed
US-8203005-B2 Manufacturing process for enantiomerically pure 8-aryloctanoic acids as Aliskiren CARBO DESIGN LLC (US) 2012-06-19 US 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 (2 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-20130225841-A1 METHOD FOR PREPARING ALISKIREN AND ITS INTERMEDIATES THEREOF FLI1, MLX, LMTK2 REN 166/4885CYP3A4 1335/4885
US-20140213821-A1 CHEMICAL PROCESS FOR OPENING RING COMPOUNDS LSS, CILK1, DCXR REN 2429/4885CYP3A4 231/4885

“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.