SCHEMBL21994602

SCHEMBL21994602

COC(=O)CCC(=O)N(C)[C@H]1CCCC[C@@H]1NC(=O)OC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.37
BTK Q06187 1/20 0.36
GAA P10253 1/20 0.35
EPHX2 P34913 3/20 0.34
CTSK P43235 2/20 0.34
HDAC4 P56524 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
CA12 O43570 1/20 0.32
CA2 P00918 1/20 0.32
CA14 Q9ULX7 1/20 0.32
PDE4B Q07343 2/20 0.32
SIGMAR1 Q99720 1/20 0.32
KMT2A Q03164 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL21995002 0.89 EPHX1 (0.40) EPHX1BTKGAACTSKHDAC4
SCHEMBL11888284 0.80 BTK (0.41) EPHX1BTKGAACTSKHDAC4
SCHEMBL24062328 0.79 BTK (0.44) EPHX1BTKGAACTSKHDAC4
SCHEMBL19773841 0.73 BTK (0.53) EPHX1BTKGAACTSKHDAC4
SCHEMBL765253 0.73 BTK (0.53) EPHX1BTKGAACTSKHDAC4
SCHEMBL12885089 0.73 BTK (0.53) EPHX1BTKGAACTSKHDAC4
SCHEMBL3826823 0.72 EPHX1 (0.43) EPHX1BTKGAAEPHX2CTSK
SCHEMBL30191596 0.72 EPHX1 (0.35) EPHX1BTKGAAHDAC4HDAC6
SCHEMBL30191514 0.71 USP2 (0.34) EPHX1BTKGAAL3MBTL1
SCHEMBL24062392 0.70 BTK (0.57) EPHX1BTKGAACTSKHDAC4

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 3 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
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 EPHX1 348/4885BTK 4194/4885GAA 1127/4885

“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.