SCHEMBL19605979

SCHEMBL19605979

CCCCCCCCCCCC(=O)N[C@@H](Cc1cccc2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C[C@@H]1CCCCC1=O)C(=O)OC

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CTSD P07339 1/20 0.44
▸ PSMB5 P28074 2/20 0.41
▸ CASP1 P29466 3/20 0.41
▸ CASP3 P42574 3/20 0.41
▸ CASP7 P55210 3/20 0.41
▸ MMP2 P08253 2/20 0.41
▸ MMP9 P14780 2/20 0.41
▸ MMP8 P22894 2/20 0.41
▸ CTSB P07858 1/20 0.41
▸ CTSK P43235 1/20 0.41
▸ CASP6 P55212 2/20 0.41
▸ CASP8 Q14790 2/20 0.41
▸ BDKRB2 P30411 2/20 0.40
▸ PLG P00747 1/20 0.39
▸ PRSS1 P07477 1/20 0.39
▸ PRSS2 P07478 1/20 0.39
▸ PRSS3 P35030 1/20 0.39
▸ KRAS P01116 1/20 0.39
▸ REN P00797 2/20 0.38

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
SCHEMBL19586589 0.89 PSMB5 (0.41) PSMB5CASP1CASP3CASP7MMP2
SCHEMBL19586587 0.89 PSMB5 (0.41) PSMB5CASP1CASP3CASP7MMP2
SCHEMBL29530281 0.89 PSMB5 (0.41) PSMB5CASP1CASP3CASP7MMP2
SCHEMBL19605978 0.89 CTSD (0.44) CTSDCASP1CASP3CASP7MMP2
SCHEMBL29530391 0.86 PSMB5 (0.52) CTSDPSMB5MMP2MMP9MMP8
SCHEMBL22875711 0.81 CTSD (0.44) CTSDPSMB5CASP1CASP3CASP7
SCHEMBL21772503 0.80 PSMB5 (0.56) CTSDPSMB5MMP2MMP9MMP8
SCHEMBL19586109 0.80 PSMB5 (0.56) CTSDPSMB5MMP2MMP9MMP8
SCHEMBL19605943 0.77 MMP2 (0.42) MMP2MMP9MMP8CTSBKRAS
SCHEMBL28563734 0.77 CTSD (0.53) CTSDPSMB5MMP2MMP9MMP8

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-11859014-B2 Peptidomimetics for the treatment of Norovirus infection EMORY UNIVERSITY (US) 2024-01-02 — — US disclosed
WO-2017197377-A1 PEPTIDOMIMETICS FOR THE TREATMENT OF NOROVIRUS INFECTION EMORY UNIVERSITY (US) 2017-11-16 — — WO 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-11859014-B2 Peptidomimetics for the treatment of Norovirus infection VIP, HAVCR2, NGLY1 CTSD 868/4885PSMB5 1096/4885CASP1 108/4885

“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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