SCHEMBL21994880

SCHEMBL21994880

NC(CCCN1CCOCC1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.54
KDM4E B2RXH2 3/20 0.53
LMNA P02545 2/20 0.53
KEAP1 Q14145 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
GLA P06280 1/20 0.52
ALDH1A1 P00352 2/20 0.47
GSR P00390 1/20 0.47
HSD17B10 Q99714 1/20 0.46
RAB9A P51151 1/20 0.45
POLB P06746 1/20 0.44
HPGD P15428 1/20 0.43
DUSP3 P51452 1/20 0.43
ANPEP P15144 1/20 0.43
PAOX Q6QHF9 1/20 0.43
ARG1 P05089 1/20 0.43

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
SCHEMBL21952349 1.00 GAA (0.54) GAAKDM4ELMNAKEAP1SMN1; SMN2
Trifluoroacetic Acid SCHEMBL27041458 0.91 GAA (0.47) GAAKDM4ELMNAKEAP1SMN1; SMN2
SCHEMBL15826790 0.89 GLA (0.55) GAAKDM4ELMNAKEAP1SMN1; SMN2
SCHEMBL1889261 0.89 GLA (0.55) GAAKDM4ELMNAKEAP1SMN1; SMN2
SCHEMBL2201068 0.87 GAA (0.57) GAAKDM4ELMNAKEAP1SMN1; SMN2
Hydrochloric Acid SCHEMBL7341620 0.87 GLA (0.58) GAAKDM4ELMNAKEAP1SMN1; SMN2
SCHEMBL18162805 0.86 GAA (0.51) GAAKDM4ELMNAKEAP1SMN1; SMN2
SCHEMBL25660549 0.85 CYP1A2 (0.52) SMN1; SMN2GLAGSRARG1
SCHEMBL23099381 0.83 CYP1A2 (0.55) SMN1; SMN2GLAALDH1A1GSRPOLB
SCHEMBL266522 0.83 CYP1A2 (0.55) SMN1; SMN2GLAALDH1A1GSRPOLB

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260001914-A1 MACROCYCLIC PEPTIDES TARGETING KRAS MERCK SHARP & DOHME LLC (US) 2026-01-01 US disclosed
US-20250277012-A1 CONJUGATED HEPCIDIN MIMETICS PROTAGONIST THERAPEUTICS, INC. 2025-09-04 US disclosed
US-20250170216-A1 CONJUGATED HEPCIDIN MIMETICS PROTAGONIST THERAPEUTICS, INC. 2025-05-29 US disclosed
EP-4558513-A1 MACROCYCLIC PEPTIDES TARGETING KRAS Merck Sharp & Dohme LLC (US) 2025-05-28 EP disclosed
WO-2024020159-A1 MACROCYCLIC PEPTIDES TARGETING KRAS MERCK SHARP & DOHME LLC (US) 2024-01-25 WO disclosed
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
CN-113166101-A Cyclic pentameric compounds as proprotein convertase subtilisin/kexin type 9 (PCSK9) inhibitors for the treatment of metabolic disorders 诺华股份有限公司 2021-07-23 CN 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 (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-20250277012-A1 CONJUGATED HEPCIDIN MIMETICS HAMP, VIP, HDGF GAA 3513/4885KDM4E 4525/4885LMNA 2431/4885
US-20230089867-A1 CYCLIC PENTAMER COMPOUNDS AS PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9 (PCSK9) INHIBITORS FOR THE TREATMENT OF METABOLIC DISORDER PCSK9, PCSK7, PCSK6 GAA 1127/4885KDM4E 3787/4885LMNA 395/4885
US-20260001914-A1 MACROCYCLIC PEPTIDES TARGETING KRAS KRAS, NRAS, HRAS GAA 2751/4885KDM4E 3980/4885LMNA 1586/4885
US-20250170216-A1 CONJUGATED HEPCIDIN MIMETICS HAMP, VIP, HDGF GAA 2518/4885KDM4E 4665/4885LMNA 1846/4885

“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.