SCHEMBL4753890

SCHEMBL4753890

CC(C)(NS(=O)(=O)N1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]nn1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 4/20 0.51
PROKR1 Q8TCW9 4/20 0.51
HRH1 P35367 16/20 0.49
CCR3 P51677 16/20 0.49
KCNH2 Q12809 5/20 0.49

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
SCHEMBL4752287 0.89 FPR2 (0.48) FPR2PROKR1HRH1CCR3KCNH2
SCHEMBL4788541 0.83 FPR2 (0.48) FPR2PROKR1
SCHEMBL5020189 0.82 FPR2 (0.52) FPR2PROKR1HRH1CCR3KCNH2
SCHEMBL5406534 0.72 HRH1 (0.61) HRH1CCR3KCNH2
SCHEMBL5020541 0.71 HRH1 (0.47) FPR2PROKR1HRH1CCR3KCNH2
SCHEMBL5020187 0.71 FPR2 (0.49) FPR2PROKR1HRH1CCR3
SCHEMBL8111588 0.70 HRH1 (0.46) FPR2PROKR1HRH1CCR3KCNH2
SCHEMBL5407400 0.70 HRH1 (0.72) HRH1CCR3KCNH2
SCHEMBL5411633 0.69 HRH1 (0.71) HRH1CCR3KCNH2
SCHEMBL5415137 0.69 HRH1 (0.71) HRH1CCR3KCNH2

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