SCHEMBL26312142

SCHEMBL26312142

CC[C@H](C)[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H](CC(=O)N(C)[C@@H](CC(=O)O)C(=O)N1CCCCC1)C(=O)N(C)C

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 4/20 0.39
▸ PIN1 Q13526 1/20 0.36
▸ CTSK P43235 4/20 0.34
▸ BACE1 P56817 1/20 0.33
▸ CTSL P07711 2/20 0.33
▸ CTSB P07858 2/20 0.33
▸ CTSS P25774 2/20 0.33
▸ DPP4 P27487 1/20 0.33

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
SCHEMBL24579295 0.97 CASP3 (0.40) CASP3PIN1CTSKCTSLCTSB
SCHEMBL26312113 0.95 CASP3 (0.41) CASP3PIN1CTSKCTSLCTSB
SCHEMBL30640797 0.95 CASP3 (0.41) CASP3PIN1CTSKCTSLCTSB
SCHEMBL24579290 0.95 CASP3 (0.41) CASP3PIN1CTSKCTSLCTSB
SCHEMBL24580479 0.92 CASP3 (0.45) CASP3PIN1CTSKCTSLCTSB
SCHEMBL26312135 0.90 CASP3 (0.38) CASP3PIN1CTSKBACE1CTSL
SCHEMBL24579942 0.90 CASP3 (0.44) CASP3PIN1CTSKCTSLCTSB
SCHEMBL24579353 0.90 CASP3 (0.40) CASP3PIN1CTSKBACE1CTSL
SCHEMBL24580469 0.89 CASP3 (0.41) CASP3PIN1CTSKCTSLCTSB
SCHEMBL24580478 0.89 CASP3 (0.47) CASP3PIN1CTSKCTSLCTSB

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-20230295221-A1 EFFICIENT PEPTIDE CONDENSATION METHOD FOR DIFFICULT SEQUENCES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-09-21 — — US disclosed
US-20230295221-A1 EFFICIENT PEPTIDE CONDENSATION METHOD FOR DIFFICULT SEQUENCES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 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-20230295221-A1 EFFICIENT PEPTIDE CONDENSATION METHOD FOR DIFFICULT SEQUENCES NGLY1, VIP, DNPEP CASP3 4334/4885PIN1 1389/4885CTSK 2092/4885

“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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