SCHEMBL8322858

SCHEMBL8322858

CCn1nc(C(F)(F)F)c(NS(=O)(=O)c2nc3cc(C)cc(Cl)n3n2)c1C

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
GLP1R P43220 1/20 0.31
KDM4E B2RXH2 2/20 0.31
RECQL P46063 1/20 0.31
NLRP3 Q96P20 1/20 0.31
SLC2A1 P11166 6/20 0.31
SLC2A3 P11169 6/20 0.31
SLC2A4 P14672 6/20 0.31
SLC2A2 P11168 3/20 0.31
S1PR1 P21453 1/20 0.30

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
SCHEMBL8321555 0.86 SMN1; SMN2 (0.39) SMN1; SMN2LMNAHTTSLC2A1SLC2A3
SCHEMBL8323109 0.85 SMN1; SMN2 (0.36) SMN1; SMN2LMNAHTT
SCHEMBL8327069 0.83 SMN1; SMN2 (0.34) SMN1; SMN2LMNAHTTSLC2A1SLC2A3
SCHEMBL8327312 0.82 SMN1; SMN2 (0.35) SMN1; SMN2LMNAHTTSLC2A1SLC2A3
SCHEMBL8323598 0.80 SMN1; SMN2 (0.34) SMN1; SMN2LMNAHTT
SCHEMBL7849629 0.74 GAA (0.38) SMN1; SMN2
SCHEMBL8327430 0.74 TSHR (0.34)
SCHEMBL7851424 0.74 NUDT1 (0.42)
SCHEMBL8326284 0.71 SMN1; SMN2 (0.34) SMN1; SMN2LMNAHTT
SCHEMBL7849728 0.70 NUDT1 (0.33)

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-0789698-B1 N-(1-ETHYL-4-PYRAZOLYL)TRIAZOLOAZINESULFONAMIDE HERBICIDES DOW AGROSCIENCES LLC (US) 1999-07-07 EP disclosed