SCHEMBL15220102

SCHEMBL15220102

CC(C)(C)OC(=O)N[C@@H](Cc1ccc(OCc2ccccc2)cc1)C(=O)NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.61
CTSS P25774 1/20 0.61
CTSK P43235 1/20 0.61
MAPT P10636 2/20 0.61
GAA P10253 1/20 0.61
HTT P42858 1/20 0.61
CCKBR P32239 4/20 0.58
CCKAR P32238 1/20 0.58
ACE P12821 1/20 0.56
LMNA P02545 1/20 0.55
KLK5 Q9Y337 1/20 0.55
PSMB1 P20618 4/20 0.55
PSMB9 P28065 3/20 0.55
PSMB5 P28074 3/20 0.55
PSMB10 P40306 3/20 0.55
PSMB2 P49721 3/20 0.55
PSMB8 P28062 2/20 0.55
KCNT1 Q5JUK3 1/20 0.54
PTPN2 P17706 1/20 0.54
PTPN1 P18031 1/20 0.54

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
SCHEMBL8251244 0.94 ACE (0.64) CTSLCTSSCTSKMAPTCCKBR
SCHEMBL8255302 0.93 CCKBR (0.59) CTSLCTSSCTSKCCKBRCCKAR
SCHEMBL15220151 0.92 CTSL (0.65) CTSLCTSSCTSKMAPTGAA
SCHEMBL15220104 0.92 CCKBR (0.58) CTSLCTSSCTSKMAPTCCKBR
SCHEMBL8257569 0.91 PSMB1 (0.66) CTSLCTSSCTSKMAPTGAA
SCHEMBL8257718 0.90 PSMB1 (0.66) CTSLCTSSCTSKMAPTGAA
SCHEMBL8255303 0.90 CCKBR (0.56) CTSLCTSSCTSKMAPTCCKBR
SCHEMBL8256701 0.90 CCKBR (0.70) CTSLCTSSCTSKMAPTGAA
SCHEMBL8251038 0.89 PSMB1 (0.67) CTSLCTSSCTSKMAPTGAA
SCHEMBL12706456 0.87 PSMB8 (0.68) CCKBRCCKARPSMB9PSMB5PSMB8

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-1865950-B1 COMPOUNDS USEFUL AS MODULATORS OF THE PROTEASOME ACTIVITY CENTRE NAT RECH SCIENT (FR) 2013-08-28 EP disclosed