SCHEMBL9565706

SCHEMBL9565706

CCOC(=O)c1cnn(C)c1S(=O)(=O)N(C(N)=NN)c1nc(OC)cc(OC)n1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.37
TSHR P16473 2/20 0.37
MEN1 O00255 1/20 0.37
POLB P06746 1/20 0.35
RAB9A P51151 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
NPC1 O15118 2/20 0.35
MAPT P10636 2/20 0.35
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 6/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
HTT P42858 1/20 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
SCHEMBL9565721 0.95 TSHR (0.41) KMT2ATSHRMEN1RAB9ASMN1; SMN2
SCHEMBL3672158 0.92 KMT2A (0.38) KMT2ATSHRMEN1POLBRAB9A
SCHEMBL9566133 0.89 KMT2A (0.48) KMT2ATSHRMEN1RAB9ASMN1; SMN2
SCHEMBL9729213 0.82 TSHR (0.40) KMT2ATSHRMEN1RAB9ASMN1; SMN2
SCHEMBL1535828 0.82 KMT2A (0.45) KMT2ATSHRSMN1; SMN2KDM4EALDH1A1
SCHEMBL9061697 0.81 MAPT (0.38) KMT2ATSHRMEN1RAB9ASMN1; SMN2
SCHEMBL8465071 0.79 KMT2A (0.36) KMT2ATSHRMEN1POLBSMN1; SMN2
SCHEMBL18209763 0.74 CYP1A2 (0.42) KMT2ATSHRMEN1RAB9ASMN1; SMN2
Pyrazosulfuron Ethyl SCHEMBL369569 0.74 GAA (0.45) KMT2ATSHRMEN1MAPTKDM4E
SCHEMBL8932208 0.73 ALDH1A1 (0.39) KMT2ATSHRMEN1POLBRAB9A

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-0529292-A2 Substituted aralkylsulfonyl-aminoguanidinoazines as herbizides BAYER AG (DE) 1993-03-03 EP disclosed