SCHEMBL30054599

SCHEMBL30054599

CN(C(=O)OCC1c2ccccc2-c2ccccc21)[C@@H](CCc1cccnc1)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.39
EPHX1 P07099 1/20 0.38
ANPEP P15144 1/20 0.38
ERAP2 Q6P179 1/20 0.38
ERAP1 Q9NZ08 1/20 0.38
LMNA P02545 2/20 0.38
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
KCNA5 P22460 1/20 0.36
CACNA1G O43497 1/20 0.36
CACNA1H O95180 1/20 0.36
CACNA1I Q9P0X4 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
FABP5 Q01469 2/20 0.36
FABP7 O15540 1/20 0.36
SLC1A5 Q15758 1/20 0.36
TBXAS1 P24557 1/20 0.36
KDM4E B2RXH2 1/20 0.36
PTAFR P25105 1/20 0.35

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
SCHEMBL25182953 1.00 CHRNA7 (0.39) CHRNA7EPHX1ANPEPERAP2ERAP1
SCHEMBL29634103 1.00 CHRNA7 (0.39) CHRNA7EPHX1ANPEPERAP2ERAP1
SCHEMBL25182955 1.00 CHRNA7 (0.39) CHRNA7EPHX1ANPEPERAP2ERAP1
SCHEMBL30055479 0.90 LMNA (0.41) EPHX1LMNAKCNA5TDP1FABP5
SCHEMBL21837837 0.90 LMNA (0.41) EPHX1LMNAKCNA5TDP1FABP5
SCHEMBL29633884 0.90 FABP5 (0.37) FABP5FABP7
SCHEMBL31369615 0.90 LMNA (0.41) EPHX1LMNAKCNA5TDP1FABP5
SCHEMBL21837839 0.90 LMNA (0.41) EPHX1LMNAKCNA5TDP1FABP5
SCHEMBL31754312 0.90 LMNA (0.41) EPHX1LMNAKCNA5TDP1FABP5
SCHEMBL29633870 0.90 LMNA (0.41) EPHX1LMNAKCNA5TDP1FABP5

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-20240148821-A1 PHARMACEUTICAL USE OF CYCLIC PEPTIDE COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-05-09 US disclosed
CN-117279655-A Pharmaceutical use of cyclic peptide compounds 中外制药株式会社 2023-12-22 CN disclosed
WO-2022234852-A1 PHARMACEUTICAL USE OF CYCLIC PEPTIDE COMPOUND 中外製薬株式会社 2022-11-10 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-20240148821-A1 PHARMACEUTICAL USE OF CYCLIC PEPTIDE COMPOUND VIP, IAPP, KRAS CHRNA7 4718/4885EPHX1 3123/4885ANPEP 50/4885

“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.