SCHEMBL7049486

SCHEMBL7049486

CS(=O)(=O)c1cccc(C[NH])c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.46
HSD17B10 Q99714 1/20 0.46
ADRA1D P25100 1/20 0.46
DRD2 P14416 3/20 0.44
NPC1 O15118 1/20 0.42
TNF P01375 1/20 0.42
RAB9A P51151 1/20 0.42
NOD1 Q9Y239 1/20 0.42
GRM2 Q14416 2/20 0.41
GRM3 Q14832 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
LOX P28300 1/20 0.41
LOXL2 Q9Y4K0 1/20 0.41
HTR6 P50406 1/20 0.40
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39
GLA P06280 1/20 0.39

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
SCHEMBL5227068 0.82 ALDH1A1 (0.45) ALDH1A1GAAHSD17B10ADRA1DDRD2
SCHEMBL2642739 0.82 PSIP1 (0.52) ALDH1A1GAANPC1TNFRAB9A
SCHEMBL7054313 0.82 ALDH1A1 (0.47) ALDH1A1GAAHSD17B10ADRA1DDRD2
SCHEMBL8233359 0.82 ALDH1A1 (0.47) ALDH1A1GAAHSD17B10DRD2NPC1
SCHEMBL14406750 0.80 ALDH1A1 (0.46) ALDH1A1GAAHSD17B10ADRA1DDRD2
SCHEMBL1127911 0.80 HTR6 (0.51) ALDH1A1GAAHSD17B10DRD2GRM2
SCHEMBL533931 0.80 ALDH1A1 (0.46) ALDH1A1GAAHSD17B10ADRA1DDRD2
SCHEMBL3446128 0.80 CA2 (0.61) ALDH1A1HTR6
SCHEMBL2542290 0.80 ALDH1A1 (0.46) ALDH1A1GAAHSD17B10ADRA1DDRD2
SCHEMBL6576001 0.80 ALDH1A1 (0.52) ALDH1A1HSD17B10NPC1TNFRAB9A

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-0882715-B1 NOVEL N-(UNSUBSTITUTED OR SUBSTITUTED)-4-SUBSTITUTED-6-(UNSUBSTITUTED OR SUBSTITUTED)PHENOXY-2-PYRIDINECARBOXAMIDES OR THIOCARBOXAMIDES, PROCESSES FOR PRODUCING THE SAME, AND HERBICIDES KUREHA CHEMICAL IND CO LTD (JP) 2003-04-23 EP disclosed
US-6339045-B1 CAN BE USED IN A SMALL AMOUNT, SHOWING A GOOD SELECTIVITY BETWEEN CROP AND WEED, AND CAUSING NO PHYTOTOXICITY KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2002-01-15 US disclosed
EP-0882715-A1 NOVEL N-(UNSUBSTITUTED OR SUBSTITUTED)-4-SUBSTITUTED-6-(UNSUBSTITUTED OR SUBSTITUTED)PHENOXY-2-PYRIDINECARBOXAMIDES OR THIOCARBOXAMIDES, PROCESSES FOR PRODUCING THE SAME, AND HERBICIDES KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1998-12-09 EP disclosed