SCHEMBL17667672

SCHEMBL17667672

CC(C)C[C@H](NC(=O)CNC(=O)c1cccc(F)c1)OB(O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR139 Q6DWJ6 10/20 0.59
PSMB11 A5LHX3 1/20 0.48
PSMA7 O14818 1/20 0.48
PSMB1 P20618 1/20 0.48
PSMA1 P25786 1/20 0.48
PSMA2 P25787 1/20 0.48
PSMA3 P25788 1/20 0.48
PSMA4 P25789 1/20 0.48
PSMB8 P28062 1/20 0.48
PSMB9 P28065 1/20 0.48
PSMA5 P28066 1/20 0.48
PSMB4 P28070 1/20 0.48
PSMB6 P28072 1/20 0.48
PSMB5 P28074 1/20 0.48
PSMB10 P40306 1/20 0.48
PSMB3 P49720 1/20 0.48
PSMB2 P49721 1/20 0.48
PSMA6 P60900 1/20 0.48
PSMA8 Q8TAA3 1/20 0.48
PSMB7 Q99436 1/20 0.48

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
SCHEMBL10005122 0.89 PSMB5 (0.47) GPR139PSMB11PSMA7PSMB1PSMA1
SCHEMBL17667670 0.87 GPR139 (0.59) GPR139PSMB11PSMA7PSMB1PSMA1
SCHEMBL17667668 0.86 SLC6A9 (0.52) GPR139PSMB11PSMA7PSMB1PSMA1
SCHEMBL10005167 0.86 PSMB11 (0.49) GPR139PSMB11PSMA7PSMB1PSMA1
SCHEMBL4802883 0.83 PSMB5 (0.69) GPR139PSMB11PSMA7PSMB1PSMA1
SCHEMBL10005139 0.83 PSMB5 (0.59) GPR139PSMB11PSMA7PSMB1PSMA1
SCHEMBL10005021 0.83 PSMB5 (0.71) GPR139PSMB11PSMA7PSMB1PSMA1
SCHEMBL30529994 0.83 PSMB5 (0.71) GPR139PSMB11PSMA7PSMB1PSMA1
SCHEMBL10004915 0.82 PSMB5 (0.55) GPR139PSMB11PSMA7PSMB1PSMA1
SCHEMBL10004622 0.82 PSMB5 (0.58) GPR139PSMB11PSMA7PSMB1PSMA1

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-2560647-B1 COMBINATION THERAPY WITH A PROTEASOME INHIBITOR AND A GALLIUM COMPLEX NIIKI PHARMA INC (US) 2016-04-13 EP claimed