SCHEMBL9513089

SCHEMBL9513089

COC(=O)c1c(Cl)n[nH]c1S(=O)(=O)N(C)C(=O)Nc1nc(OC)cc(OC)n1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.40
MAPT P10636 3/20 0.36
TP53 P04637 1/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
CDK1 P06493 1/20 0.35
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 2/20 0.34
TSHR P16473 1/20 0.33
KMT2A Q03164 2/20 0.33
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
F2 P00734 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL9509345 0.94 TSHR (0.41) CYP1A2MAPTALDH1A1TSHRHTT
SCHEMBL9512536 0.92 MAPT (0.39) CYP1A2MAPTTP53GLAALDH1A1
SCHEMBL9511781 0.88 ALDH1A1 (0.42) MAPTALDH1A1KDM4ETSHRHTT
SCHEMBL5792011 0.81 GAA (0.52) CYP1A2MAPTTP53GLAGAA
SCHEMBL9514426 0.80 MAPT (0.39) CYP1A2MAPTTP53GLAGAA
SCHEMBL10917864 0.74 MAPT (0.35) CYP1A2MAPTTP53GLAGAA
SCHEMBL3642355 0.73 ALDH1A1 (0.41) CYP1A2MAPTTP53GLAGAA
SCHEMBL4465650 0.71 CYP1A2 (0.37) CYP1A2MAPTTP53GLAGAA
SCHEMBL10921368 0.71 MAPT (0.38) CYP1A2MAPTTP53GLAGAA
SCHEMBL9364434 0.69 CYP1A2 (0.48) CYP1A2MAPTTP53GLAGAA

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
EP-0565593-A1 REDUCING PESTICIDAL INTERACTIONS IN CROPS MONSANTO COMPANY (US) 1993-10-20 EP disclosed
EP-0452500-A1 SULFAMIDOSULFONYLUREA DERIVATIVES AND HERBICIDES. NISSAN CHEMICAL IND LTD (JP) 1991-10-23 EP disclosed