SCHEMBL9876240

SCHEMBL9876240

CN(C)S(=O)(=O)n1cc(S(=O)(=O)c2ccccc2)nc1C#N

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.38
TSHR P16473 1/20 0.37
ALDH1A1 P00352 4/20 0.34
MAPT P10636 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HTR6 P50406 4/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
ABCB1 P08183 2/20 0.33
ABCC1 P33527 2/20 0.33
HTT P42858 1/20 0.33
LMNA P02545 1/20 0.33
PKM P14618 1/20 0.33
AKR1B1 P15121 1/20 0.33
GRM5 P41594 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
SCHEMBL9521448 0.80 TSHR (0.46) KDM4ETSHRALDH1A1NPSR1SMN1; SMN2
SCHEMBL9736764 0.79 HTT (0.41) ALDH1A1MAPTHTTLMNAPKM
SCHEMBL9735952 0.76 TSHR (0.50) KDM4ETSHRALDH1A1MAPTNPSR1
SCHEMBL9735234 0.76 KMT2A (0.44) KDM4ETSHRMAPTNPSR1SMN1; SMN2
SCHEMBL9736879 0.74 L3MBTL1 (0.44) TSHRALDH1A1SMN1; SMN2LMNA
SCHEMBL9845735 0.73 GAA (0.40) KDM4EALDH1A1MAPTNPSR1SMN1; SMN2
SCHEMBL9736151 0.72 LMNA (0.46) TSHRALDH1A1MAPTNPSR1SMN1; SMN2
SCHEMBL9736209 0.71 KDM4E (0.31) KDM4ETSHR
SCHEMBL9734425 0.70 SORD (0.33) KDM4E
SCHEMBL9737725 0.69 TSHR (0.46) KDM4ETSHRALDH1A1MAPTNPSR1

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
US-5045557-A Imidazable fungicides and use thereof SCHERING AGROCHEMICALS LTD. (GB) 1991-09-03 US disclosed
EP-0284277-A1 Cyanoimidazole fungicides AgrEvo UK Limited (GB) 1988-09-28 EP disclosed