SCHEMBL23616293

SCHEMBL23616293

CC(C)CC(C=O)NC(=O)[C@H](CCc1ccccc1)NC=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 3/20 0.56
ACE P12821 1/20 0.50
CTSL P07711 7/20 0.49
CTSB P07858 5/20 0.48
MEN1 O00255 1/20 0.48
HTT P42858 1/20 0.48
KMT2A Q03164 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
PSMB1 P20618 1/20 0.47
PSMB5 P28074 1/20 0.47
PSMB2 P49721 1/20 0.47
MMP1 P03956 1/20 0.47
MMP2 P08253 1/20 0.47
MMP12 P39900 1/20 0.47
MMP13 P45452 1/20 0.47
MMP8 P22894 1/20 0.45
CTSK P43235 2/20 0.45
CTSH P09668 1/20 0.45
CTSC P53634 1/20 0.45
CTSS P25774 1/20 0.45

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
SCHEMBL23616270 0.88 SMN1; SMN2 (0.50) CTSLMEN1HTTKMT2ASMN1; SMN2
SCHEMBL19663542 0.82 CAPN1 (0.58) CAPN1ACECTSLCTSBMEN1
SCHEMBL8259852 0.82 CTSB (0.62) CTSLCTSBMEN1KMT2APSMB1
SCHEMBL23616285 0.82 MME (0.55) ACEMMP2MMP12MMP13
SCHEMBL23616375 0.82 MMP3 (0.66) CAPN1MMP1MMP2
SCHEMBL17238783 0.81 CAPN1 (0.53) CAPN1CTSLCTSBPSMB1PSMB5
SCHEMBL8436260 0.80 ACE (0.73) CAPN1ACECTSLMEN1HTT
SCHEMBL22043608 0.79 CTSB (0.57) CAPN1CTSLCTSBPSMB1PSMB5
SCHEMBL20881480 0.79 CTSB (0.57) CAPN1CTSLCTSBPSMB1PSMB5
SCHEMBL24115066 0.79 CTSB (0.57) CAPN1CTSLCTSBPSMB1PSMB5

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
EP-3297678-B1 AN IMPROVED PROCESSES FOR THE PREPARATION OF CARFILZOMIB OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF LAURUS LABS LTD (IN) 2021-07-07 EP disclosed