SCHEMBL9512705

SCHEMBL9512705

CCOC(=O)Cc1c(Cl)n[nH]c1S(=O)(=O)NC(=O)Nc1nc(OC)cc(OC)n1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.48
CDK1 P06493 1/20 0.38
ALDH1A1 P00352 4/20 0.37
MAPT P10636 2/20 0.37
KDM4E B2RXH2 2/20 0.37
CYP1A2 P05177 1/20 0.37
TP53 P04637 1/20 0.36
GLA P06280 1/20 0.36
NPC1 O15118 1/20 0.35
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL9511795 0.95 GAA (0.44) GAACDK1ALDH1A1MAPTKDM4E
SCHEMBL9513100 0.92 GAA (0.52) GAACDK1ALDH1A1MAPTKDM4E
SCHEMBL6455000 0.81 GAA (0.47) GAACDK1ALDH1A1MAPTKDM4E
SCHEMBL5792011 0.79 GAA (0.52) GAACDK1ALDH1A1MAPTKDM4E
SCHEMBL6455018 0.79 GAA (0.49) GAACDK1ALDH1A1MAPTKDM4E
SCHEMBL11046520 0.75 GAA (0.52) GAACDK1ALDH1A1MAPTKDM4E
SCHEMBL10521521 0.75 GAA (0.49) GAACDK1ALDH1A1MAPTKDM4E
SCHEMBL5790911 0.74 GAA (0.53) GAACDK1ALDH1A1MAPTKDM4E
SCHEMBL5633455 0.73 GAA (0.55) GAACDK1ALDH1A1MAPTKDM4E
SCHEMBL13486990 0.72 GAA (0.48) GAACDK1ALDH1A1MAPTKDM4E

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-0562015-A1 SAFENED HERBICIDAL SULFONAMIDE COMPOSITIONS MONSANTO COMPANY (US) 1993-09-29 EP disclosed