SCHEMBL24733719

SCHEMBL24733719

CN(C)C(=O)[C@H](CC(=O)O)N(C)C(=O)[C@H](C1CCCC1)N(C)C(=O)C1(NC(=O)OCc2ccccc2)CCCC1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSS P25774 6/20 0.44
CTSL P07711 5/20 0.44
CTSB P07858 4/20 0.44
CTSK P43235 5/20 0.41
ALDH1A1 P00352 1/20 0.37
CASP3 P42574 2/20 0.36
EPHX1 P07099 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP3A4 P08684 2/20 0.35
TSHR P16473 1/20 0.35
CASP1 P29466 2/20 0.35
SIGMAR1 Q99720 1/20 0.35

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
SCHEMBL24733718 0.90 CTSS (0.40) CTSSCTSLCTSBCTSKALDH1A1
SCHEMBL24823157 0.86 MMP9 (0.34) CTSSCTSLCTSBCTSKCYP3A4
SCHEMBL24733599 0.86 KMT2A (0.50) CTSSCTSBCTSKALDH1A1MEN1
SCHEMBL24733470 0.78 KMT2A (0.43) CTSSCTSBCTSKALDH1A1MEN1
SCHEMBL5520069 0.76 CTSS (0.62) CTSSCTSLCTSBCTSKALDH1A1
SCHEMBL24734869 0.73 ABCB1 (0.40) CTSSCTSLCTSBCTSKCYP3A4
SCHEMBL25801540 0.72 LMNA (0.34)
SCHEMBL31185276 0.70 CASP3 (0.36) CASP3KMT2A
SCHEMBL23879154 0.70 ABCB1 (0.52) CTSSCTSLCTSBCTSKALDH1A1
SCHEMBL24579268 0.70 CASP3 (0.41) CASP3KMT2ATSHR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4570813-A1 METHOD FOR PRODUCING N-SUBSTITUTED AMINO ACID RESIDUE-CONTAINING CYCLIC PEPTIDE COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-06-18 EP disclosed
US-20220411462-A1 METHODS FOR PRODUCING CYCLIC COMPOUNDS COMPRISING N-SUBSTITUTED AMINO ACID RESIDUES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2022-12-29 US disclosed
EP-4086272-A1 METHODS FOR PRODUCING CYCLIC COMPOUNDS COMPRISING N-SUBSTITUTED AMINO ACID RESIDUES Chugai Seiyaku Kabushiki Kaisha (JP) 2022-11-09 EP 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-20220411462-A1 METHODS FOR PRODUCING CYCLIC COMPOUNDS COMPRISING N-SUBSTITUTED AMINO ACID RESIDUES NGLY1, NPPA, VIP CTSS 3476/4885CTSL 1689/4885CTSB 3757/4885

“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.