SCHEMBL16359196

SCHEMBL16359196

Cc1cc(C(=O)N2CCC(O)CC2)cc(C)c1/C=C/S(=O)(=O)N1CCC2(CC1)N=C(c1ccc(F)c(OF)c1)NC2=O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTH1R Q03431 6/20 0.36
KDR P35968 3/20 0.36
PDGFRB P09619 2/20 0.36
CNR2 P34972 1/20 0.32
JAK2 O60674 1/20 0.32
LRRK2 Q5S007 1/20 0.31
NTRK1 P04629 1/20 0.31
PARP1 P09874 1/20 0.30
ACACB O00763 1/20 0.30
ACACA Q13085 1/20 0.30

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
SCHEMBL848039 0.94 PTH1R (0.41) PTH1RKDRPDGFRBCNR2JAK2
SCHEMBL848040 0.94 PTH1R (0.41) PTH1RKDRPDGFRBCNR2JAK2
SCHEMBL16302498 0.90 PTH1R (0.37) PTH1R
SCHEMBL849625 0.90 PTH1R (0.37) PTH1RKDRPDGFRBCNR2JAK2
SCHEMBL849624 0.90 PTH1R (0.37) PTH1RKDRPDGFRBCNR2JAK2
SCHEMBL849018 0.89 PTH1R (0.36) PTH1RKDRPDGFRB
SCHEMBL849017 0.89 PTH1R (0.36) PTH1RKDRPDGFRB
SCHEMBL16302547 0.88 PTH1R (0.35) PTH1RKDRPDGFRBCNR2
SCHEMBL848576 0.87 PTH1R (0.42) PTH1R
SCHEMBL848575 0.87 PTH1R (0.42) PTH1R

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
WO-2010126030-A1 SPIROIMIDAZOLONE DERIVATIVE 中外製薬株式会社 (JP) 2010-11-04 WO disclosed