SCHEMBL26305268

SCHEMBL26305268

CCOCC(=O)NCCOCCOCC(=O)NCCCCC1NC(=O)[C@@H]([C@@H](C)CC)NC(=O)[C@@H](NC(=O)[C@@H]2CCCN2C(=O)C(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)OC)NC(=O)CC(C)C)[C@@H](C)O)C(c2ccccc2)c2ccccc2)CSSC[C@@H](C(N)=O)NC(=O)[C@@H](CCCCN)NC(=O)C[C@H](Cc2ccccc2)NC1=O

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CXCR4 P61073 4/20 0.48
▸ NPY2R P49146 1/20 0.43
▸ GLP1R P43220 6/20 0.43
▸ PRLHR P49683 1/20 0.43
▸ CSNK2A2 P19784 1/20 0.42
▸ CSNK2B P67870 1/20 0.42
▸ CSNK2A1 P68400 1/20 0.42
▸ CSNK2A3 Q8NEV1 1/20 0.42
▸ INSR P06213 1/20 0.42
▸ KCNA3 P22001 1/20 0.42
▸ KCNA1 Q09470 1/20 0.42
▸ OPRD1 P41143 4/20 0.42
▸ RXFP4 Q8TDU9 1/20 0.42
▸ RXFP3 Q9NSD7 1/20 0.42

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
SCHEMBL26307010 0.89 NPY2R (0.48) NPY2RPRLHRCSNK2A2CSNK2BCSNK2A1
SCHEMBL26292602 0.88 RAMP3 (0.49) NPY2RGLP1RPRLHRCSNK2A2CSNK2B
SCHEMBL26292620 0.87 RAMP3 (0.47) PRLHRCSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL26292629 0.87 RAMP3 (0.47) PRLHRCSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL29311858 0.86 KCNA3 (0.43) CXCR4NPY2RPRLHRCSNK2A2CSNK2B
SCHEMBL29311844 0.86 APLNR (0.43) NPY2RPRLHRCSNK2A2CSNK2BCSNK2A1
SCHEMBL29311773 0.85 CXCR4 (0.41) CXCR4GLP1RPRLHRCSNK2A2CSNK2B
SCHEMBL29311618 0.85 CSNK2A2 (0.46) CXCR4NPY2RGLP1RCSNK2A2CSNK2B
SCHEMBL29311547 0.84 CSNK2A2 (0.43) CXCR4NPY2RPRLHRCSNK2A2CSNK2B
SCHEMBL29311757 0.84 CSNK2A2 (0.43) CXCR4NPY2RPRLHRCSNK2A2CSNK2B

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-20230295259-A1 Conjugated Hepcidin Mimetics PROTAGONIST THERAPEUTICS, INC. 2023-09-21 — — 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-20230295259-A1 Conjugated Hepcidin Mimetics HAMP, VIP, HDGF CXCR4 920/4885NPY2R 602/4885GLP1R 42/4885

“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.

Send feedback