SCHEMBL9876077

SCHEMBL9876077

CN(C)S(=O)(=O)n1cc(-c2ccc(Cl)cc2Cl)nc1C1=NC(=O)C(=O)S1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
ALPL P05186 1/20 0.35
HSP90AA1 P07900 1/20 0.34
HSP90AB1 P08238 1/20 0.34
MAPT P10636 3/20 0.34
HPGD P15428 3/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
KDM4E B2RXH2 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MCOLN3 Q8TDD5 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
HSD11B1 P28845 1/20 0.32
ALDH1A1 P00352 3/20 0.32
KMT2A Q03164 2/20 0.32
USP2 O75604 1/20 0.32
PSD A5PKW4 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
SCHEMBL9876169 0.74 LMNA (0.43) LMNAALPLHSP90AA1HSP90AB1MCOLN3
SCHEMBL9876158 0.74 LMNA (0.42) LMNAALPLHSP90AA1HSP90AB1MAPT
SCHEMBL9876241 0.73 LMNA (0.41) LMNAALPLHSP90AA1HSP90AB1MAPT
SCHEMBL9876901 0.71 LMNA (0.42) LMNAALPLHSP90AA1HSP90AB1HPGD
SCHEMBL9876172 0.70 LMNA (0.39) LMNAALPLHSP90AA1HSP90AB1MAPT
SCHEMBL9876018 0.67 ALPL (0.41) LMNAALPLHSP90AA1HSP90AB1MAPT
SCHEMBL9875589 0.61 HPGD (0.39) LMNAMAPTHPGDKDM4ENPSR1
SCHEMBL1691500 0.60 CYP19A1 (0.57) LMNAHSP90AA1HSP90AB1MAPTHPGD
SCHEMBL7591843 0.59 LMNA (0.53) LMNAALPLHSP90AA1HSP90AB1MAPT
SCHEMBL9876574 0.59 MAPT (0.33) ALPLMAPTSMN1; SMN2

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