SCHEMBL2931762

SCHEMBL2931762

Cc1ccc(NC[C@H](NC(=O)c2cc(-c3ccccc3)ccn2)C(=O)N[CH]CC(C)C)cc1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTSA P10619 4/20 0.45
PSEN1 P49768 3/20 0.39
PSEN2 P49810 3/20 0.39
APH1B Q8WW43 3/20 0.39
NCSTN Q92542 3/20 0.39
APH1A Q96BI3 3/20 0.39
PSENEN Q9NZ42 3/20 0.39
PSMB5 P28074 2/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
PSMB8 P28062 1/20 0.38
CTSD P07339 1/20 0.38
CNR1 P21554 2/20 0.37
CTSK P43235 3/20 0.37
GFER P55789 1/20 0.37
CTSL P07711 2/20 0.36
CTSS P25774 2/20 0.36
WNT3A P56704 1/20 0.36

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
SCHEMBL2927696 0.88 CTSA (0.44) CTSAPSMB5NFKB1NFKB2RELA
SCHEMBL2931767 0.84 CTSA (0.46) CTSAPSEN1PSEN2APH1BNCSTN
SCHEMBL2931761 0.79 CTSA (0.47) CTSAPSEN1PSEN2APH1BNCSTN
SCHEMBL2931860 0.76 KMT2A (0.53) PSMB5CTSKGFER
SCHEMBL2927821 0.76 KMO (0.38) PSMB5NFKB1NFKB2RELACNR1
SCHEMBL2935262 0.75 EGLN1 (0.46) CTSAPSMB5NFKB1NFKB2RELA
SCHEMBL2931806 0.73 HDAC3 (0.40) PSMB5NFKB1NFKB2RELACNR1
SCHEMBL2927699 0.73 NPC1 (0.53) CTSAPSMB5NFKB1NFKB2RELA
SCHEMBL2930833 0.72 SMN1; SMN2 (0.47)
SCHEMBL2935509 0.72 SMN1; SMN2 (0.46) CTSAPSMB5NFKB1NFKB2RELA

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-1846424-B1 PROTEASOME INHIBITORS AND METHODS OF USING THE SAME CEPHALON INC (US) 2010-01-27 EP claimed