SCHEMBL16358347

SCHEMBL16358347

Cc1cc(N(C)C(=O)OC(C)(C)C)cc(C)c1CCS(=O)(=O)N1CCC(N)(CCCN)CC1

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTH1R Q03431 9/20 0.44
SMYD3 Q9H7B4 1/20 0.31

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
SCHEMBL16302489 0.85 PTH1R (0.46) PTH1R
SCHEMBL850573 0.85 PTH1R (0.48) PTH1R
SCHEMBL13553438 0.84 PTH1R (0.45) PTH1R
SCHEMBL16358767 0.83 PTH1R (0.46) PTH1R
SCHEMBL851546 0.82 PTH1R (0.45) PTH1R
SCHEMBL13553439 0.80 PTH1R (0.44) PTH1R
SCHEMBL13553463 0.76 PTH1R (0.43) PTH1R
SCHEMBL849084 0.76 PTH1R (0.61) PTH1R
SCHEMBL13065283 0.75 PTH1R (0.43) PTH1R
SCHEMBL850946 0.75 PTH1R (0.40) 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