SCHEMBL21995194

SCHEMBL21995194

COC[C@H](N)C(=O)N(C)[C@H](CC(=O)O)Cc1ccc(Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
TSHR P16473 1/20 0.38
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
ALDH1A1 P00352 1/20 0.38
NPY5R Q15761 1/20 0.37
SLC6A2 P23975 1/20 0.37
SLC6A3 Q01959 1/20 0.37
PPARG P37231 3/20 0.37
PPARA Q07869 3/20 0.37
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
MME P08473 1/20 0.36
LMNA P02545 1/20 0.36
PMP22 Q01453 1/20 0.36
NLRP3 Q96P20 1/20 0.36
CTSC P53634 1/20 0.36

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
SCHEMBL21995197 1.00 MAOB (0.39) MAOBL3MBTL1TSHRKMT2AMEN1
SCHEMBL21994827 0.84 KMT2A (0.38) MAOBL3MBTL1KMT2AMEN1ALDH1A1
SCHEMBL21994387 0.84 KMT2A (0.38) MAOBL3MBTL1KMT2AMEN1ALDH1A1
SCHEMBL23723858 0.81 LTA4H (0.39) MAOBKMT2AMEN1ALDH1A1NPY5R
SCHEMBL23723854 0.81 LTA4H (0.39) MAOBKMT2AMEN1ALDH1A1NPY5R
SCHEMBL30191477 0.79 KIF11 (0.34) MAOBL3MBTL1TSHRNPY5RCYP2D6
SCHEMBL28611955 0.77 TDP1 (0.34) TSHRKMT2AALDH1A1LMNA
SCHEMBL21994342 0.74 MAOB (0.41) MAOBL3MBTL1KMT2AMEN1ALDH1A1
SCHEMBL21994341 0.74 MAOB (0.41) MAOBL3MBTL1KMT2AMEN1ALDH1A1
SCHEMBL4988762 0.69 SLC6A2 (0.53) L3MBTL1TSHRKMT2AMEN1SLC6A2

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 MAOB 1789/4885L3MBTL1 1682/4885TSHR 622/4885

“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.