SCHEMBL21995147

SCHEMBL21995147

CN(C(=O)[C@@H](CC(=O)O)Cc1ccccc1)C1CCOCC1NC(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KDM1A O60341 1/20 0.37
MAOB P27338 1/20 0.37
ATM Q13315 1/20 0.36
CCR5 P51681 1/20 0.36
CPA1 P15085 2/20 0.36
CPB1 P15086 1/20 0.36
CPA3 P15088 1/20 0.36
CPB2 Q96IY4 1/20 0.36
KLK5 Q9Y337 1/20 0.35
CTSS P25774 2/20 0.35
CTSL P07711 1/20 0.35
CTSB P07858 1/20 0.35
CTSK P43235 1/20 0.35
SCN9A Q15858 1/20 0.35
LTA4H P09960 2/20 0.35

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
SCHEMBL21995149 1.00 KMT2A (0.40) KMT2AL3MBTL1KDM1AMAOBATM
SCHEMBL30191155 0.94 KMT2A (0.39) KMT2AL3MBTL1KDM1AMAOBATM
SCHEMBL21994399 0.79 CPA1 (0.43) CPA1CPB1CPA3CPB2LTA4H
SCHEMBL28619292 0.79 CPA1 (0.43) CPA1CPB1CPA3CPB2LTA4H
SCHEMBL28619288 0.79 CPA1 (0.43) CPA1CPB1CPA3CPB2LTA4H
SCHEMBL21994397 0.79 CPA1 (0.43) CPA1CPB1CPA3CPB2LTA4H
SCHEMBL21995157 0.74 KMT2A (0.36) KMT2AL3MBTL1KDM1AMAOBATM
SCHEMBL30191669 0.74 ITGB1 (0.38) KDM1AMAOBCTSLLTA4H
SCHEMBL30191824 0.74 ITGB1 (0.38) KDM1AMAOBCTSLLTA4H
SCHEMBL21994414 0.73 HDAC4 (0.34) KMT2AL3MBTL1KDM1AMAOBCCR5

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 KMT2A 3622/4885L3MBTL1 1682/4885KDM1A 3162/4885

“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.