SCHEMBL14536616

SCHEMBL14536616

CCN(Cc1ccc(C)cc1)S(=O)(=O)S

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 18/20 0.54
CNR1 P21554 6/20 0.49
TAS2R14 Q9NYV8 1/20 0.43

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
SCHEMBL14253619 0.83 L3MBTL1 (0.57) CNR2CNR1TAS2R14
SCHEMBL10328554 0.83 CNR2 (0.55) CNR2CNR1TAS2R14
SCHEMBL12863040 0.80 CNR2 (0.74) CNR2CNR1TAS2R14
SCHEMBL10328557 0.73 CNR2 (0.50) CNR2CNR1
SCHEMBL12862830 0.73 CNR2 (0.59) CNR2CNR1TAS2R14
SCHEMBL12763728 0.69 HRH3 (0.62) CNR2
SCHEMBL5925786 0.69 HRH3 (0.70) CNR2
SCHEMBL5023540 0.68 HTT (0.73) CNR2CNR1
SCHEMBL12136891 0.68 GAA (0.51) CNR2TAS2R14
Water SCHEMBL9810829 0.67 HRH3 (0.67) CNR2

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
EP-1519756-B1 USE OF METAL COMPLEXES CONTAINING PERFLUOROALKYL AS CONTRAST AGENTS IN MAGNETIC RESONANCE IMAGING FOR REPRESENTING INTRAVASCULAR THROMBI BAYER SCHERING PHARMA AG (DE) 2007-05-02 EP disclosed