SCHEMBL20198343

SCHEMBL20198343

Cc1ccccc1S(=O)(=O)c1ccc(-c2ccc(S(=O)(=O)c3ccccc3)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.54
HTR6 P50406 6/20 0.52
MMP1 P03956 6/20 0.50
MMP2 P08253 6/20 0.50
MMP9 P14780 6/20 0.50
MMP12 P39900 6/20 0.50
MMP13 P45452 6/20 0.50
MMP14 P50281 6/20 0.50
MMP8 P22894 5/20 0.50
MMP16 P51512 5/20 0.50
ALDH1A1 P00352 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
POLB P06746 2/20 0.50
MAPT P10636 1/20 0.50
MMP3 P08254 5/20 0.49
KMT2A Q03164 1/20 0.47
ABCC9 O60706 1/20 0.47
ABCC8 Q09428 1/20 0.47
KCNJ11 Q14654 1/20 0.47
KCNJ8 Q15842 1/20 0.47

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
SCHEMBL28053976 0.94 MMP1 (0.55) HSD11B1HTR6MMP1MMP2MMP9
SCHEMBL12336792 0.94 HTR6 (0.58) HSD11B1HTR6ALDH1A1SMN1; SMN2POLB
(Phenylsulfonyl)Benzene SCHEMBL6332793 0.92 HTR6 (0.61) HSD11B1HTR6ALDH1A1SMN1; SMN2POLB
SCHEMBL1713160 0.90 HTR6 (0.57) HSD11B1HTR6ALDH1A1SMN1; SMN2POLB
SCHEMBL31092469 0.90 HTR6 (0.57) HSD11B1HTR6ALDH1A1SMN1; SMN2POLB
(Phenylsulfonyl)Benzene SCHEMBL10595193 0.88 HTR6 (0.61) HSD11B1HTR6ALDH1A1SMN1; SMN2POLB
SCHEMBL20198254 0.86 HTR6 (0.58) HSD11B1HTR6MMP1MMP2MMP9
SCHEMBL27713196 0.85 HSD11B1 (0.53) HSD11B1HTR6ALDH1A1SMN1; SMN2POLB
SCHEMBL4402282 0.83 ALDH1A1 (0.53) HTR6MMP1MMP2MMP9MMP12
SCHEMBL30893040 0.82 GAA (0.60) HSD11B1ALDH1A1SMN1; SMN2MAPTKMT2A

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-1675930-B1 NEW MATERIALS FOR ELECTROLUMINESCENCE AND THE UTILIZATION THEREOF MERCK PATENT GMBH (DE) 2018-05-30 EP disclosed