SCHEMBL30865

SCHEMBL30865

C/C(=C/[C@@H](Cc1ccc(-c2ccccc2)cc1)NC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSS P25774 11/20 0.59
CTSK P43235 9/20 0.59
CTSB P07858 3/20 0.51
CTSL P07711 1/20 0.51
PTPN1 P18031 1/20 0.51
ATM Q13315 1/20 0.50
BCL2 P10415 1/20 0.50
PPARA Q07869 3/20 0.47
APP P05067 1/20 0.47
ACE P12821 2/20 0.47
PPARG P37231 2/20 0.46
MME P08473 1/20 0.44
ACE2 Q9BYF1 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
SCHEMBL28572952 1.00 CTSS (0.59) CTSSCTSKCTSBCTSLPTPN1
SCHEMBL30866 1.00 CTSS (0.59) CTSSCTSKCTSBCTSLPTPN1
SCHEMBL45753 1.00 CTSS (0.59) CTSSCTSKCTSBCTSLPTPN1
SCHEMBL29373190 1.00 CTSS (0.59) CTSSCTSKCTSBCTSLPTPN1
SCHEMBL30867 1.00 CTSS (0.59) CTSSCTSKCTSBCTSLPTPN1
SCHEMBL18765 1.00 CTSS (0.59) CTSSCTSKCTSBCTSLPTPN1
SCHEMBL13566632 1.00 CTSS (0.59) CTSSCTSKCTSBCTSLPTPN1
SCHEMBL15415630 0.93 ATM (0.57) CTSSCTSKCTSBCTSLATM
SCHEMBL2507124 0.93 ATM (0.57) CTSSCTSKCTSBCTSLATM
SCHEMBL15415629 0.93 ATM (0.57) CTSSCTSKCTSBCTSLATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9802887-B2 Process for the preparation of intermediates useful for the manufacture NEP inhibitors NOVARTIS AG (CH) 2017-10-31 US claimed
EP-2609071-B1 NEW PROCESS FOR THE PREPARATION OF INTERMEDIATES USEFUL FOR THE MANUFACTURE OF NEP INHIBITORS NOVARTIS AG (CH) 2016-09-21 EP claimed
US-20150274650-A1 PROCESS FOR THE PREPARATION OF INTERMEDIATES USEFUL FOR THE MANUFACTURE NEP INHIBITORS HOOK DAVID (CH) 2015-10-01 US claimed
US-9802887-B2 Process for the preparation of intermediates useful for the manufacture NEP inhibitors NOVARTIS AG (CH) 2017-10-31 US disclosed
US-9802887-B2 Process for the preparation of intermediates useful for the manufacture NEP inhibitors NOVARTIS AG (CH) 2017-10-31 US disclosed
EP-2609071-B1 NEW PROCESS FOR THE PREPARATION OF INTERMEDIATES USEFUL FOR THE MANUFACTURE OF NEP INHIBITORS NOVARTIS AG (CH) 2016-09-21 EP disclosed
US-20150274650-A1 PROCESS FOR THE PREPARATION OF INTERMEDIATES USEFUL FOR THE MANUFACTURE NEP INHIBITORS HOOK DAVID (CH) 2015-10-01 US disclosed
US-9085529-B2 Process for the preparation of intermediates useful for the manufacture NEP inhibitors NOVARTIS AG (CH) 2015-07-21 US disclosed
EP-2609071-A1 NEW PROCESS FOR THE PREPARATION OF INTERMEDIATES USEFUL FOR THE MANUFACTURE NEP INHIBITORS Novartis AG (CH) 2013-07-03 EP disclosed
US-20130158275-A1 NEW PROCESS FOR THE PREPARATION OF INTERMEDIATES USEFUL FOR THE MANUFACTURE NEP INHIBITORS NOVARTIS AG (CH) 2013-06-20 US disclosed
WO-2012025502-A1 NEW PROCESS FOR THE PREPARATION OF INTERMEDIATES USEFUL FOR THE MANUFACTURE NEP INHIBITORS NOVARTIS AG (CH) 2012-03-01 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 (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-20130158275-A1 NEW PROCESS FOR THE PREPARATION OF INTERMEDIATES USEFUL FOR THE MANUFACTURE NEP INHIBITORS MME, DNPEP, REN CTSS 528/4885CTSK 1306/4885CTSB 473/4885
US-20150274650-A1 PROCESS FOR THE PREPARATION OF INTERMEDIATES USEFUL FOR THE MANUFACTURE NEP INHIBITORS MME, DNPEP, REN CTSS 539/4885CTSK 1034/4885CTSB 399/4885

“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.