SCHEMBL30799559

SCHEMBL30799559

N[C@@H](CCO)C(=O)N[C@@H](CC1CCCCC1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 16/20 0.48
GRN P28799 1/20 0.48
SORT1 Q99523 1/20 0.48
FNTA P49354 1/20 0.47
FNTB P49356 1/20 0.47
PGGT1B P53609 1/20 0.47
LTA4H P09960 1/20 0.46
MME P08473 1/20 0.43
ACE P12821 1/20 0.43
CPA1 P15085 1/20 0.43
ACE2 Q9BYF1 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
SCHEMBL30799462 0.88 GRN (0.50) CPB2GRNSORT1FNTAFNTB
SCHEMBL29387045 0.88 GRN (0.52) CPB2GRNSORT1FNTAFNTB
SCHEMBL30799634 0.86 CPB2 (0.46) CPB2GRNSORT1FNTAFNTB
SCHEMBL30732913 0.85 CPB2 (0.51) CPB2GRNSORT1FNTAFNTB
SCHEMBL30541625 0.85 CPB2 (0.51) CPB2GRNSORT1FNTAFNTB
SCHEMBL30438211 0.85 CPB2 (0.63) CPB2
SCHEMBL29641088 0.85 CPB2 (0.49) CPB2GRNSORT1FNTAFNTB
SCHEMBL9146938 0.84 LTA4H (0.50) CPB2GRNSORT1FNTAFNTB
SCHEMBL9146946 0.84 LTA4H (0.50) CPB2GRNSORT1FNTAFNTB
SCHEMBL31181255 0.82 ITGB3 (0.49) CPB2GRNSORT1FNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240116985-A1 STAPLED PEPTIDES AND METHODS THEREOF PARABILIS MEDICINES, INC. 2024-04-11 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 (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-20240116985-A1 STAPLED PEPTIDES AND METHODS THEREOF CTNNB1, APC, CTNNA1 CPB2 590/4885GRN 537/4885SORT1 1084/4885

“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.