SCHEMBL9198014

SCHEMBL9198014

Cc1cc(C)nc(NC(=O)NS(=O)(=O)c2c(Cl)c(C)nn2C)n1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.48
ALOX15 P16050 1/20 0.41
ESR1 P03372 1/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MAPT P10636 1/20 0.40
PCTP Q9UKL6 3/20 0.39
STARD10 Q9Y365 1/20 0.39
LMNA P02545 3/20 0.37
RAB9A P51151 2/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPC1 O15118 1/20 0.36
CYP1A2 P05177 1/20 0.36
CASP1 P29466 1/20 0.36

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
SCHEMBL9202018 0.83 GAA (0.48) GAAALOX15ESR1HPGDHSD17B10
SCHEMBL9199902 0.77 GAA (0.47) GAAALOX15MAPTLMNASMN1; SMN2
SCHEMBL9201862 0.75 GAA (0.46) GAAALOX15ESR1HPGDHSD17B10
SCHEMBL8358944 0.75 GAA (0.46) GAAALOX15MAPTLMNASMN1; SMN2
SCHEMBL10673663 0.75 GAA (0.46) GAAALOX15MAPTLMNASMN1; SMN2
SCHEMBL9199996 0.74 GAA (0.45) GAAALOX15ESR1HPGDHSD17B10
SCHEMBL9201779 0.74 ALDH1A1 (0.46) GAAMAPTLMNAKMT2ASMN1; SMN2
SCHEMBL11204912 0.74 KMT2A (0.41) GAAALOX15ESR1HPGDHSD17B10
SCHEMBL10847775 0.72 GAA (0.58) GAAALOX15MAPTLMNARAB9A
SCHEMBL8352131 0.72 GAA (0.43) GAAMAPTLMNASMN1; SMN2

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-0087780-B2 Pyrazolesulfonylurea derivative, preparation thereof, herbicide containing said derivative as active ingredient and herbicidal method by use thereof NISSAN CHEMICAL IND LTD (JP) 1995-02-15 EP disclosed
US-4954164-A Pyrazolesulfonylurea derivatives, preparation thereof, herbicide containing said derivative as active ingredient and herbicidal method by use thereof NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1990-09-04 US disclosed
EP-0087780-A2 Pyrazolesulfonylurea derivative, preparation thereof, herbicide containing said derivative as active ingredient and herbicidal method by use thereof NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1983-09-07 EP disclosed