SCHEMBL29311576

SCHEMBL29311576

CC[C@H]1NC(=O)[C@H](CCCCNC(C)=O)NC(=O)C[C@H](Cc2ccccc2)NC(=O)[C@@H](CCCCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@@H](NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](NC(=O)[C@H](CC2N=NN=N2)NC(=O)CC(C)C)[C@@H](C)O)C(c2ccccc2)c2ccccc2)CSSC[C@@H](C(N)=O)NC1=O

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ VEGFA P15692 6/20 0.44
▸ CHRNA10 Q9GZZ6 1/20 0.42
▸ CHRNA9 Q9UGM1 1/20 0.42
▸ CTNNB1 P35222 1/20 0.41
▸ SLC40A1 Q9NP59 1/20 0.41
▸ PRLHR P49683 9/20 0.40
▸ NPFFR2 Q9Y5X5 7/20 0.40
▸ INSR P06213 1/20 0.40
▸ CSNK2A2 P19784 1/20 0.40
▸ CSNK2B P67870 1/20 0.40
▸ CSNK2A1 P68400 1/20 0.40
▸ CSNK2A3 Q8NEV1 1/20 0.40

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
SCHEMBL29311547 0.95 CSNK2A2 (0.43) VEGFACHRNA10CHRNA9CTNNB1SLC40A1
SCHEMBL29311757 0.95 CSNK2A2 (0.43) VEGFACHRNA10CHRNA9CTNNB1SLC40A1
SCHEMBL29311858 0.93 KCNA3 (0.43) VEGFACTNNB1SLC40A1PRLHRNPFFR2
SCHEMBL29311844 0.92 APLNR (0.43) VEGFACHRNA10CHRNA9CTNNB1SLC40A1
SCHEMBL26292629 0.91 RAMP3 (0.47) CHRNA10CHRNA9CTNNB1SLC40A1PRLHR
SCHEMBL26292620 0.91 RAMP3 (0.47) CHRNA10CHRNA9CTNNB1SLC40A1PRLHR
SCHEMBL29311793 0.87 KCNA3 (0.43) VEGFACTNNB1PRLHRNPFFR2INSR
SCHEMBL29311773 0.87 CXCR4 (0.41) PRLHRINSRCSNK2A2CSNK2BCSNK2A1
SCHEMBL26307010 0.86 NPY2R (0.48) CTNNB1PRLHRINSRCSNK2A2CSNK2B
SCHEMBL26292602 0.86 RAMP3 (0.49) CTNNB1SLC40A1PRLHRCSNK2A2CSNK2B

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-20240226225-A1 CONJUGATED HEPCIDIN MIMETICS PROTAGONIST THERAPEUTICS, INC. (US) 2024-07-11 — — 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-20240226225-A1 CONJUGATED HEPCIDIN MIMETICS HAMP, SLC40A1, FTH1 VEGFA 131/4885CHRNA10 4882/4885CHRNA9 4880/4885

“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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