SCHEMBL24754754

SCHEMBL24754754

CC(C)C[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSS P25774 7/20 0.66
CTSK P43235 6/20 0.66
REN P00797 6/20 0.59
CTSL P07711 1/20 0.52
CTSB P07858 1/20 0.52
MAPK1 P28482 1/20 0.52
ACE P12821 1/20 0.50
ITGB3 P05106 1/20 0.50
ITGA2B P08514 1/20 0.50

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
SCHEMBL24754850 1.00 CTSS (0.66) CTSSCTSKRENCTSLCTSB
SCHEMBL29184618 1.00 CTSS (0.66) CTSSCTSKRENCTSLCTSB
SCHEMBL22962085 0.97 REN (0.64) CTSSCTSKRENCTSLCTSB
SCHEMBL24754846 0.90 CTSS (0.62) CTSSCTSKREN
SCHEMBL29184663 0.90 CTSS (0.62) CTSSCTSKREN
SCHEMBL24754751 0.90 CTSS (0.62) CTSSCTSKREN
SCHEMBL30698082 0.90 CTSS (0.65) CTSSCTSKRENCTSLCTSB
SCHEMBL12242944 0.90 REN (0.71) CTSSCTSKRENCTSLCTSB
SCHEMBL7269523 0.90 REN (0.71) CTSSCTSKRENCTSLCTSB
SCHEMBL24224252 0.90 REN (0.71) CTSSCTSKRENCTSLCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4355370-A1 PEPTIDE DRUG CONJUGATES Oncopeptides Innovation AB (SE) 2024-04-24 EP disclosed
CN-117794580-A Polypeptide coupling medicine 肿瘤多肽有限公司 2024-03-29 CN disclosed
WO-2022263679-A1 PEPTIDE DRUG CONJUGATES ONCOPEPTIDES AB (SE) 2022-12-22 WO disclosed
WO-2022263679-A1 PEPTIDE DRUG CONJUGATES ONCOPEPTIDES AB (SE) 2022-12-22 WO disclosed