SCHEMBL30009160

SCHEMBL30009160

C[C@H](O)[C@@H](NC(=O)[C@@H](Cc1c[nH]cn1)NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@H](CC(=O)O)C(N)=O

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CALCRL Q16602 5/20 0.48
▸ BACE1 P56817 3/20 0.45
▸ BACE2 Q9Y5Z0 2/20 0.45
▸ OPRD1 P41143 3/20 0.43
▸ OPRM1 P35372 2/20 0.43
▸ OPRK1 P41145 1/20 0.43
▸ KISS1R Q969F8 4/20 0.41
▸ CASP3 P42574 1/20 0.41
▸ CASP7 P55210 1/20 0.41

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
SCHEMBL30746746 0.90 OPRD1 (0.49) CALCRLBACE1OPRD1OPRM1OPRK1
SCHEMBL29961965 0.90 CALCRL (0.37) CALCRLBACE1BACE2OPRD1OPRM1
SCHEMBL29882808 0.88 OPRD1 (0.50) BACE1OPRD1OPRM1OPRK1
SCHEMBL29456530 0.88 OPRD1 (0.50) BACE1OPRD1OPRM1OPRK1
SCHEMBL2742710 0.87 CALCRL (0.37) CALCRLBACE1BACE2OPRD1CASP3
SCHEMBL12873177 0.87 CALCRL (0.37) CALCRLBACE1BACE2OPRD1CASP3
SCHEMBL30475883 0.86 PTPN1 (0.51) CALCRLBACE1BACE2
SCHEMBL29546019 0.85 MME (0.51) —
SCHEMBL12603082 0.85 ERBB2 (0.39) CALCRLBACE1BACE2
SCHEMBL31039959 0.85 MME (0.45) OPRD1OPRM1

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-11807674-B2 Hepcidin analogues and uses thereof PROTAGONIST THERAPEUTICS, INC. (US) 2023-11-07 — — US disclosed
US-11472842-B2 Analogues of hepcidin mimetics with improved in vivo half lives PROTAGONIST THERAPEUTICS, INC. (US) 2022-10-18 — — 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-11472842-B2 Analogues of hepcidin mimetics with improved in vivo half lives HAMP, VIP, HDGF CALCRL 57/4885BACE1 1262/4885BACE2 1803/4885
US-11807674-B2 Hepcidin analogues and uses thereof HAMP, SLC40A1, FTH1 CALCRL 134/4885BACE1 1506/4885BACE2 2817/4885

“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.

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