SCHEMBL9517838

SCHEMBL9517838

CCOC(=O)c1c(S(N)(=O)=O)nc2sccn12

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.67
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 4/20 0.47
HPGD P15428 4/20 0.47
HSD17B10 Q99714 3/20 0.47
RECQL P46063 1/20 0.47
RXFP1 Q9HBX9 1/20 0.43
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
TP53 P04637 1/20 0.39
STS P08842 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
SCHEMBL8226978 0.88 MAPK1 (0.69) MAPK1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL952278 0.81 MAPK1 (1.00) MAPK1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL8812585 0.77 MAPK1 (0.72) MAPK1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL2827309 0.76 MAPK1 (0.71) MAPK1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL9517362 0.76 MAPK1 (0.71) MAPK1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL23783453 0.76 MAPK1 (0.70) MAPK1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL8229886 0.75 MAPK1 (0.69) MAPK1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL1339451 0.74 MAPK1 (0.67) MAPK1ALDH1A1KDM4EHPGDHSD17B10
Bromide SCHEMBL11329559 0.72 CYP1A2 (0.65) MAPK1ALDH1A1HSD17B10NPC1RAB9A
Hydrochloric Acid SCHEMBL11316868 0.72 CYP1A2 (0.65) MAPK1ALDH1A1HSD17B10NPC1RAB9A

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