SCHEMBL30799723

SCHEMBL30799723

CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCCN)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 3/20 0.57
OPRM1 P35372 1/20 0.56
OPRD1 P41143 1/20 0.56
NPY1R P25929 1/20 0.55
NPY2R P49146 1/20 0.55
NPY4R P50391 1/20 0.55
LTA4H P09960 1/20 0.54
BACE1 P56817 2/20 0.53
MME P08473 2/20 0.53
MMP2 P08253 1/20 0.51
NTSR2 O95665 1/20 0.51
NTSR1 P30989 1/20 0.51

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
SCHEMBL31343356 0.96 OPRK1 (0.60) OPRK1OPRM1OPRD1NPY1RNPY2R
SCHEMBL29798006 0.96 OPRK1 (0.61) OPRK1OPRM1NPY1RNPY2RNPY4R
SCHEMBL31134058 0.94 NPY4R (0.61) OPRK1NPY1RNPY2RNPY4RBACE1
SCHEMBL29679986 0.94 NPY4R (0.62) OPRK1OPRM1NPY1RNPY2RNPY4R
SCHEMBL30799335 0.94 MMP2 (0.55) OPRK1OPRM1OPRD1NPY1RNPY2R
SCHEMBL30799661 0.93 OPRK1 (0.60) OPRK1OPRM1OPRD1NPY1RNPY2R
SCHEMBL30880418 0.92 OPRK1 (0.57) OPRK1OPRM1OPRD1NPY1RNPY2R
SCHEMBL31181190 0.92 OPRK1 (0.57) OPRK1OPRM1OPRD1NPY1RNPY2R
SCHEMBL31554972 0.92 MMP2 (0.56) OPRK1OPRM1OPRD1NPY1RNPY2R
SCHEMBL30497073 0.92 MMP2 (0.56) OPRK1OPRM1OPRD1NPY1RNPY2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240360179-A1 STAPLED PEPTIDES AND METHODS THEREOF PARABILIS MEDICINES, INC. 2024-10-31 US disclosed
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 (2 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 OPRK1 3407/4885OPRM1 4382/4885OPRD1 4412/4885
US-20240360179-A1 STAPLED PEPTIDES AND METHODS THEREOF CTNNB1, APC, CTNNA1 OPRK1 3434/4885OPRM1 4418/4885OPRD1 4448/4885

“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.