SCHEMBL21978262

SCHEMBL21978262

O=C(C[C@H]1COc2ccccc21)N1C(=O)OC[C@@H]1Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 2/20 0.44
LTB4R2 Q9NPC1 2/20 0.44
MAOB P27338 1/20 0.44
NAAA Q02083 3/20 0.42
PSMB5 P28074 1/20 0.42
PPARG P37231 3/20 0.40
PPARD Q03181 3/20 0.40
PTGDR2 Q9Y5Y4 3/20 0.39
PPARA Q07869 2/20 0.39
HTR1A P08908 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
FFAR1 O14842 2/20 0.38
RIPK1 Q13546 2/20 0.37
NPC1 O15118 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
HPGD P15428 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL22035434 1.00 LTB4R (0.44) LTB4RLTB4R2MAOBNAAAPSMB5
SCHEMBL21978263 1.00 LTB4R (0.44) LTB4RLTB4R2MAOBNAAAPSMB5
SCHEMBL30660191 0.82 NAAA (0.41) NAAAPPARDPTGDR2PPARAHTR1A
SCHEMBL21978180 0.82 NAAA (0.46) MAOBNAAAPPARA
SCHEMBL22035769 0.82 NAAA (0.46) MAOBNAAAPPARA
SCHEMBL21978687 0.82 NAAA (0.41) NAAAPPARDPTGDR2PPARAHTR1A
SCHEMBL21978183 0.82 NAAA (0.46) MAOBNAAAPPARA
SCHEMBL31326507 0.82 NAAA (0.46) MAOBNAAAPPARA
SCHEMBL21979196 0.81 HTR1A (0.42) NAAAPSMB5PPARAHTR1A
SCHEMBL15873097 0.81 NAAA (0.44) NAAAPPARA

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-11813306-B2 Cyclic tetramer compounds as proprotein convertase subtilisin/kexin type 9 (PCSK9) inhibitors for the treatment of metabolic disorders NOVARTIS AG (CH) 2023-11-14 US disclosed
US-20210252103-A1 CYCLIC TETRAMER COMPOUNDS AS PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9 (PCSK9) INHIBITORS FOR THE TREATMENT OF METABOLIC DISORDERS NOVARTIS AG (CH) 2021-08-19 US disclosed
US-11026993-B2 Cyclic tetramer compounds as proprotein convertase subtilisin/kexin type 9 (PCSK9) inhibitors for the treatment of metabolic disorders NOVARTIS AG (CH) 2021-06-08 US disclosed
US-20200164024-A1 CYCLIC TETRAMER COMPOUNDS AS PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9 (PCSK9) INHIBITORS FOR THE TREATMENT OF METABOLIC DISORDERS NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. 2020-05-28 US 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 (4 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-20210252103-A1 CYCLIC TETRAMER COMPOUNDS AS PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9 (PCSK9) INHIBITORS FOR THE TREATMENT OF METABOLIC DISORDERS PCSK9, PCSK7, PCSK6 LTB4R 928/4885LTB4R2 1829/4885MAOB 3125/4885
US-11026993-B2 Cyclic tetramer compounds as proprotein convertase subtilisin/kexin type 9 (PCSK9) inhibitors for the treatment of metabolic disorders PCSK9, PCSK7, PCSK6 LTB4R 928/4885LTB4R2 1829/4885MAOB 3125/4885
US-11813306-B2 Cyclic tetramer compounds as proprotein convertase subtilisin/kexin type 9 (PCSK9) inhibitors for the treatment of metabolic disorders PCSK9, PCSK7, PCSK6 LTB4R 928/4885LTB4R2 1829/4885MAOB 3125/4885
US-20200164024-A1 CYCLIC TETRAMER COMPOUNDS AS PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9 (PCSK9) INHIBITORS FOR THE TREATMENT OF METABOLIC DISORDERS PCSK9, PCSK7, PCSK6 LTB4R 928/4885LTB4R2 1829/4885MAOB 3125/4885

“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.