SCHEMBL21994414

SCHEMBL21994414

Cc1cccc(CC(CC(=O)O)C(=O)N(C)[C@H]2CCCC[C@@H]2NC(=O)OC(C)(C)C)n1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
SYK P43405 3/20 0.34
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
TGFBR1 P36897 1/20 0.33
KMT2A Q03164 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPT P10636 1/20 0.33
MAOB P27338 2/20 0.32
MAOA P21397 1/20 0.32
KDM1A O60341 1/20 0.32
MEN1 O00255 1/20 0.32
OPRM1 P35372 1/20 0.32
OPRD1 P41143 1/20 0.32
F2R P25116 1/20 0.32
CCR5 P51681 1/20 0.32
ACACB O00763 1/20 0.31
ACACA Q13085 1/20 0.31

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
SCHEMBL21994413 1.00 HDAC4 (0.34) HDAC4HDAC6SYKCHRM2CHRM1
SCHEMBL21994440 0.80 FFAR2 (0.34) SYKCHRM2CHRM1CHRM3KMT2A
SCHEMBL21994437 0.80 FFAR2 (0.34) SYKCHRM2CHRM1CHRM3KMT2A
SCHEMBL21995157 0.79 KMT2A (0.36) HDAC4HDAC6KMT2AL3MBTL1MAOB
SCHEMBL21995460 0.77 EPHX1 (0.35) HDAC4HDAC6KMT2AL3MBTL1MAOB
SCHEMBL21995458 0.77 EPHX1 (0.35) HDAC4HDAC6KMT2AL3MBTL1MAOB
SCHEMBL21994916 0.76 BTK (0.33) KMT2AL3MBTL1MAOBMAOA
SCHEMBL21994918 0.76 BTK (0.33) KMT2AL3MBTL1MAOBMAOA
SCHEMBL21994631 0.76 CTSK (0.39) MAOBMAOA
SCHEMBL21994629 0.76 CTSK (0.39) MAOBMAOA

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 HDAC4 3190/4885HDAC6 2428/4885SYK 3393/4885

“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.