SCHEMBL21994717

SCHEMBL21994717

CC(C)(C)OC(=O)NC(CN1CCC1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSK P43235 8/20 0.43
CTSS P25774 6/20 0.43
PPARA Q07869 6/20 0.42
PPARG P37231 5/20 0.42
CTSL P07711 2/20 0.42
CTSB P07858 2/20 0.42
ACE P12821 1/20 0.41
PPARD Q03181 2/20 0.41
MAPK1 P28482 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 1/20 0.40
TSHR P16473 1/20 0.39
IDO1 P14902 1/20 0.39

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
SCHEMBL21994715 1.00 CTSK (0.43) CTSKCTSSPPARAPPARGCTSL
SCHEMBL26119172 0.97 CTSK (0.47) CTSKCTSSPPARAPPARGCTSL
SCHEMBL26119175 0.97 CTSK (0.47) CTSKCTSSPPARAPPARGCTSL
SCHEMBL26121197 0.95 CTSK (0.46) CTSKCTSSPPARAPPARGCTSL
SCHEMBL2748877 0.95 CTSK (0.46) CTSKCTSSPPARAPPARGCTSL
SCHEMBL5142788 0.94 CTSK (0.45) CTSKCTSSPPARAPPARGCTSL
SCHEMBL2781237 0.88 CTSS (0.42) CTSKCTSSPPARAPPARGCTSL
SCHEMBL4360723 0.87 ALDH1A1 (0.48) CTSKCTSSPPARAPPARGCTSL
SCHEMBL5354771 0.87 ALDH1A1 (0.48) CTSKCTSSPPARAPPARGCTSL
SCHEMBL30191278 0.87 PADI1 (0.45) CTSKCTSSCTSLCTSBCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230089867-A1 CYCLIC PENTAMER COMPOUNDS AS PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9 (PCSK9) INHIBITORS FOR THE TREATMENT OF METABOLIC DISORDER NOVARTIS AG (CH) 2023-03-23 US disclosed
EP-3887363-A1 CYCLIC PENTAMER COMPOUNDS AS PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9 (PCSK9) INHIBITORS FOR THE TREATMENT OF METABOLIC DISORDER Novartis AG (CH) 2021-10-06 EP disclosed
CN-113166101-A Cyclic pentameric compounds as proprotein convertase subtilisin/kexin type 9 (PCSK9) inhibitors for the treatment of metabolic disorders 诺华股份有限公司 2021-07-23 CN disclosed
WO-2020110008-A1 CYCLIC PENTAMER COMPOUNDS AS PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9 (PCSK9) INHIBITORS FOR THE TREATMENT OF METABOLIC DISORDER NOVARTIS AG (CH) 2020-06-04 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-20230089867-A1 CYCLIC PENTAMER COMPOUNDS AS PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9 (PCSK9) INHIBITORS FOR THE TREATMENT OF METABOLIC DISORDER PCSK9, PCSK7, PCSK6 CTSK 644/4885CTSS 703/4885PPARA 2673/4885

“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.