SCHEMBL4752287

SCHEMBL4752287

CC(C)(NS(=O)(=O)N1CCC(Oc2ccc(Cl)cc2)CC1)c1c[nH]nn1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 10/20 0.48
PROKR1 Q8TCW9 10/20 0.48
MMP12 P39900 1/20 0.43
MMP13 P45452 1/20 0.43
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HRH1 P35367 3/20 0.41
CCR3 P51677 3/20 0.41
ACLY P53396 1/20 0.38
KCNH2 Q12809 2/20 0.36
MMP1 P03956 1/20 0.36
EPHX2 P34913 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
SCHEMBL4753890 0.89 FPR2 (0.51) FPR2PROKR1HRH1CCR3KCNH2
SCHEMBL4788541 0.88 FPR2 (0.48) FPR2PROKR1MMP12MMP13MAPT
SCHEMBL4789823 0.81 HSD11B1 (0.47) MAPT
SCHEMBL5020187 0.81 FPR2 (0.49) FPR2PROKR1MMP12MMP13MAPT
SCHEMBL4753032 0.76 FPR2 (0.47) FPR2PROKR1MMP12MMP13MAPT
SCHEMBL4789296 0.76 GPR119 (0.43) SMN1; SMN2
SCHEMBL8096418 0.74 FPR2 (0.46) FPR2PROKR1MMP12MMP13MAPT
SCHEMBL5020189 0.71 FPR2 (0.52) FPR2PROKR1HRH1CCR3KCNH2
SCHEMBL4752293 0.70 FPR2 (0.57) FPR2PROKR1MMP12MMP13MAPT
SCHEMBL8286689 0.69 ACLY (0.45) FPR2PROKR1MMP12MMP13MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008147764-A1 MMP INHIBITORS AND METHODS OF USE THEREOF ARRAY BIOPHARMA, INC. (US) 2008-12-04 WO claimed
WO-2008147764-A1 MMP INHIBITORS AND METHODS OF USE THEREOF ARRAY BIOPHARMA, INC. (US) 2008-12-04 WO disclosed