SCHEMBL9845735

SCHEMBL9845735

CN(C)S(=O)(=O)n1cc(S(=O)(=O)N2CCOCC2)nc1C#N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.40
CYP1A2 P05177 1/20 0.40
KDM4E B2RXH2 5/20 0.37
ALDH1A1 P00352 5/20 0.37
HPGD P15428 4/20 0.37
HSD17B10 Q99714 4/20 0.37
KMT2A Q03164 3/20 0.37
HSD11B1 P28845 3/20 0.36
HTT P42858 1/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 3/20 0.34
LMNA P02545 1/20 0.34
NPC1 O15118 1/20 0.34
MAPK1 P28482 1/20 0.34
RAB9A P51151 1/20 0.34
MEN1 O00255 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
USP2 O75604 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP2C9 P11712 1/20 0.33

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
SCHEMBL9736764 0.83 HTT (0.41) GAAALDH1A1HPGDHSD17B10KMT2A
SCHEMBL9735234 0.78 KMT2A (0.44) CYP1A2KDM4EKMT2AMAPTLMNA
SCHEMBL9876240 0.73 KDM4E (0.38) KDM4EALDH1A1HTTMAPTLMNA
SCHEMBL9735952 0.73 TSHR (0.50) GAAKDM4EALDH1A1HSD17B10KMT2A
SCHEMBL9736879 0.71 L3MBTL1 (0.44) ALDH1A1KMT2ALMNAMAPK1MEN1
SCHEMBL27265306 0.70 KMT2A (0.45) GAAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9736151 0.69 LMNA (0.46) ALDH1A1KMT2APOLBMAPTLMNA
SCHEMBL9736209 0.68 KDM4E (0.31) GAAKDM4EKMT2A
SCHEMBL9734425 0.67 SORD (0.33) GAAKDM4E
SCHEMBL29483656 0.66 THRB (0.55) GAAKDM4EALDH1A1HPGDHSD17B10

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-0432892-A1 Imidazole fungicides AgrEvo UK Limited (GB) 1991-06-19 EP disclosed