SCHEMBL89597

SCHEMBL89597

COCC[C@H](NC(=O)OC(C)(C)C)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSK P43235 7/20 0.51
CTSS P25774 4/20 0.51
MAPT P10636 2/20 0.48
ATM Q13315 1/20 0.45
CTSL P07711 1/20 0.43
CTSB P07858 1/20 0.43
GABRB1 P18505 1/20 0.43
GABRB2 P47870 1/20 0.43
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43

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
SCHEMBL90359 1.00 CTSK (0.51) CTSKCTSSMAPTATMCTSL
SCHEMBL13184597 0.89 CTSK (0.53) CTSKCTSSMAPTATMCTSL
SCHEMBL19312076 0.89 CTSK (0.53) CTSKCTSSMAPTATMCTSL
SCHEMBL7754157 0.89 CTSK (0.53) CTSKCTSSMAPTATMCTSL
SCHEMBL90723 0.86 CTSK (0.49) CTSKCTSSMAPTATMCTSL
SCHEMBL89576 0.86 CTSK (0.49) CTSKCTSSMAPTATMCTSL
SCHEMBL392486 0.86 UTS2R (0.46) MAPTPPARGPPARA
SCHEMBL4712952 0.86 CTSK (0.51) CTSKCTSSMAPTATMCTSL
SCHEMBL6185014 0.86 CTSK (0.51) CTSKCTSSMAPTATMCTSL
SCHEMBL27488331 0.86 CTSK (0.51) CTSKCTSSMAPTATMCTSL

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 CTSK 863/4885CTSS 301/4885MAPT 1089/4885

“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.