SCHEMBL21994442

SCHEMBL21994442

COC(=O)C(CNC(=O)CC(Cc1ccc(Cl)cc1)N(C)C(=O)OC(C)(C)C)N(C)C(=O)C(CC(=O)OC(C)(C)C)Cc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
REN P00797 1/20 0.38
LTA4H P09960 1/20 0.36
KLK5 Q9Y337 2/20 0.36
ABCB1 P08183 1/20 0.35
ADORA1 P30542 1/20 0.35
OPRK1 P41145 4/20 0.35
OPRM1 P35372 2/20 0.35
MAOB P27338 1/20 0.34
FFAR2 O15552 2/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL21994445 1.00 CA2 (0.40) CA2CA9RENLTA4HKLK5
SCHEMBL21994952 0.79 ADORA1 (0.38) RENKLK5ADORA1OPRK1OPRM1
SCHEMBL21994950 0.79 ADORA1 (0.38) RENKLK5ADORA1OPRK1OPRM1
SCHEMBL30191543 0.78 CA2 (0.39) CA2CA9LTA4HOPRK1OPRM1
SCHEMBL28624622 0.78 PPARG (0.39) ADORA1OPRK1OPRM1KMT2A
SCHEMBL21994785 0.77 LMNA (0.37) KMT2A
SCHEMBL21994783 0.77 LMNA (0.37) KMT2A
SCHEMBL21994680 0.75 CA2 (0.36) CA2CA9RENLTA4HOPRK1
SCHEMBL28961616 0.73 ADAMTS5 (0.41) KMT2A
SCHEMBL28961615 0.73 ADAMTS5 (0.41) KMT2A

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 CA2 3021/4885CA9 532/4885REN 14/4885

“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.