SCHEMBL879649

SCHEMBL879649

Cc1ccc(C(N)=O)cc1CCS(=O)(=O)N1CCC2(CC1)N=C(c1cccc(O)c1)NC2=O

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTH1R Q03431 12/20 0.47
PIK3CD O00329 3/20 0.34
PIK3CA P42336 2/20 0.34
PIK3CB P42338 2/20 0.34
PIK3CG P48736 2/20 0.34
ENPP2 Q13822 1/20 0.34
ATXN2 Q99700 1/20 0.34
SLC6A9 P48067 1/20 0.32

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
SCHEMBL16302228 0.88 PTH1R (0.41) PTH1RENPP2ATXN2
SCHEMBL16302225 0.88 PTH1R (0.42) PTH1RSLC6A9
SCHEMBL13552145 0.80 PTH1R (0.56) PTH1RSLC6A9
SCHEMBL879732 0.80 PTH1R (0.43) PTH1R
SCHEMBL16302187 0.79 PTH1R (0.46) PTH1R
SCHEMBL17346272 0.78 PTH1R (0.55) PTH1R
SCHEMBL848391 0.78 PTH1R (0.54) PTH1RSLC6A9
SCHEMBL847358 0.78 PTH1R (0.57) PTH1RSLC6A9
SCHEMBL16358654 0.78 PTH1R (0.46) PTH1RENPP2ATXN2
SCHEMBL879653 0.78 PTH1R (0.44) PTH1RSLC6A9

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
EP-2433940-A1 SPIROIMIDAZOLONE DERIVATIVE Chugai Seiyaku Kabushiki Kaisha (JP) 2012-03-28 EP disclosed
WO-2010126030-A1 SPIROIMIDAZOLONE DERIVATIVE 中外製薬株式会社 (JP) 2010-11-04 WO disclosed