SCHEMBL9517166

SCHEMBL9517166

O=S(=O)(F)c1c(F)nc2ccccn12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.46
KDM4E B2RXH2 6/20 0.46
GLA P06280 4/20 0.46
GAA P10253 4/20 0.46
HSD17B10 Q99714 3/20 0.46
HPGD P15428 3/20 0.46
NPC1 O15118 3/20 0.46
CASP1 P29466 1/20 0.46
CASP7 P55210 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.44
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
MAPT P10636 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
POLB P06746 2/20 0.39
KMT2A Q03164 2/20 0.39
RAB9A P51151 2/20 0.39
MEN1 O00255 1/20 0.39
HTR6 P50406 2/20 0.39
PTGS1 P23219 1/20 0.38

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
SCHEMBL9517202 0.85 ALDH1A1 (0.44) ALDH1A1KDM4EGLAGAAHSD17B10
SCHEMBL3315853 0.74 KDM4E (0.56) ALDH1A1KDM4EGLAGAAHSD17B10
SCHEMBL30172989 0.71 KDM4E (0.52) ALDH1A1KDM4EGLAGAAHSD17B10
SCHEMBL9362818 0.69 KDM4E (0.54) ALDH1A1KDM4EGLAGAAHSD17B10
SCHEMBL25261995 0.68 KMT2A (0.51) ALDH1A1KDM4EGLAGAAHSD17B10
SCHEMBL8973958 0.68 KDM4E (0.53) ALDH1A1KDM4EGLAGAAHSD17B10
SCHEMBL9363441 0.68 KDM4E (0.53) ALDH1A1KDM4EGLAGAAHSD17B10
SCHEMBL5332506 0.68 MAPT (0.47) ALDH1A1KDM4EGLAGAAHSD17B10
SCHEMBL29174927 0.68 PTGS1 (0.61) ALDH1A1KDM4EGLAGAAHSD17B10
SCHEMBL23415067 0.67 HTR6 (0.44) ALDH1A1KDM4EGLAGAAHSD17B10

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0238070-B1 Sulfonylurea compounds, their production and herbicidal use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1993-12-29 EP disclosed
US-5017212-A For rice paddies TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1991-05-21 US disclosed
EP-0238070-A2 Sulfonylurea compounds, their production and herbicidal use Takeda Chemical Industries, Ltd. (JP) 1987-09-23 EP disclosed