SCHEMBL9876158

SCHEMBL9876158

CN(C)S(=O)(=O)n1cc(-c2ccc(Cl)cc2Cl)nc1C=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
ALPL P05186 4/20 0.38
HSP90AA1 P07900 2/20 0.36
HSP90AB1 P08238 2/20 0.36
MCOLN3 Q8TDD5 2/20 0.36
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MAPT P10636 2/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
HSD11B1 P28845 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
AR P10275 1/20 0.34
DPP4 P27487 2/20 0.33
DPP8 Q6V1X1 2/20 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
SCHEMBL9876172 0.86 LMNA (0.39) LMNAALPLHSP90AA1HSP90AB1MCOLN3
SCHEMBL9876574 0.84 MAPT (0.33) ALPLMAPTSMN1; SMN2
SCHEMBL9875494 0.83
SCHEMBL9876241 0.80 LMNA (0.41) LMNAALPLHSP90AA1HSP90AB1MCOLN3
SCHEMBL9876169 0.79 LMNA (0.43) LMNAALPLHSP90AA1HSP90AB1MCOLN3
SCHEMBL9876901 0.78 LMNA (0.42) LMNAALPLHSP90AA1HSP90AB1MCOLN3
SCHEMBL7513475 0.75 TSHR (0.47) ALDH1A1KDM4EHPGDNPSR1MAPT
SCHEMBL1481853 0.74 LMNA (0.46) LMNAALPLHSP90AA1HSP90AB1ALDH1A1
SCHEMBL9876077 0.74 LMNA (0.36) LMNAALPLHSP90AA1HSP90AB1MCOLN3
SCHEMBL9876018 0.73 ALPL (0.41) LMNAALPLHSP90AA1HSP90AB1MCOLN3

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