SCHEMBL9202018

SCHEMBL9202018

Cc1cc(C)nc(NC(=O)NS(=O)(=O)c2c(C)nn(C)c2Cl)n1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.48
ACLY P53396 2/20 0.44
HTR6 P50406 1/20 0.43
MCL1 Q07820 1/20 0.42
MAPT P10636 2/20 0.41
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
ALOX15 P16050 1/20 0.41
ESR1 P03372 1/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CCR2 P41597 1/20 0.39
SGK1 O00141 2/20 0.38
PCTP Q9UKL6 1/20 0.38
NLRP3 Q96P20 2/20 0.37

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
SCHEMBL9198014 0.83 GAA (0.48) GAAMAPTLMNACYP1A2ALOX15
SCHEMBL9201862 0.82 GAA (0.46) GAAMAPTLMNAALOX15ESR1
SCHEMBL9199996 0.81 GAA (0.45) GAAMAPTLMNACYP1A2ALOX15
SCHEMBL11204912 0.80 KMT2A (0.41) GAAMAPTCYP1A2ALOX15ESR1
SCHEMBL9202334 0.78 GAA (0.48) GAAMAPTLMNACYP1A2ALOX15
SCHEMBL9204315 0.77 GAA (0.41) GAAMAPTLMNAALOX15ESR1
SCHEMBL9204321 0.77 GAA (0.41) GAAMAPTLMNAALOX15ESR1
SCHEMBL11560916 0.77 GAA (0.49) GAAMAPTLMNAALOX15PCTP
SCHEMBL3956139 0.77 ACLY (0.51) GAAACLYHTR6MCL1MAPT
SCHEMBL10473716 0.76 GAA (0.44) GAAMAPTLMNACYP1A2ALOX15

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