SCHEMBL11044879

SCHEMBL11044879

COc1cc(C)nc(NC(=O)NS(=O)(=O)c2ccccc2CS(C)(=O)=O)n1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
GAA P10253 1/20 0.49
CDK1 P06493 1/20 0.44
MAPT P10636 2/20 0.43
TP53 P04637 1/20 0.43
GLA P06280 1/20 0.43
HTT P42858 1/20 0.42
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL11049002 0.94 GAA (0.56) GAACDK1MAPTTP53GLA
SCHEMBL11045419 0.90 LMNA (0.46) TSHRGAAMAPTKDM4ENPC1
SCHEMBL11125345 0.90 TSHR (0.52) TSHRSMN1; SMN2GAACDK1MAPT
SCHEMBL11119679 0.89 SMN1; SMN2 (0.47) TSHRSMN1; SMN2GAACDK1MAPT
SCHEMBL11050733 0.89 TSHR (0.51) TSHRSMN1; SMN2GAACDK1MAPT
SCHEMBL10801614 0.88 SMN1; SMN2 (0.50) TSHRSMN1; SMN2GAACDK1MAPT
SCHEMBL11049312 0.88 SMN1; SMN2 (0.53) TSHRSMN1; SMN2GAACDK1MAPT
SCHEMBL11045303 0.87 TSHR (0.49) TSHRSMN1; SMN2GAACDK1MAPT
SCHEMBL11046113 0.86 GAA (0.50) TSHRSMN1; SMN2GAACDK1MAPT
SCHEMBL10733365 0.85 GAA (0.53) TSHRSMN1; SMN2GAACDK1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0044209-B1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-10-31 EP claimed
US-4348220-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1982-09-07 US claimed
EP-0044209-A1 Herbicidal sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1982-01-20 EP claimed
EP-0044209-B1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-10-31 EP disclosed
US-4424377-A HERBICIDES E. I. DU PONT DE NEMOURS & CO. (US) 1984-01-03 US disclosed
US-4348220-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1982-09-07 US disclosed
EP-0044209-A1 Herbicidal sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1982-01-20 EP disclosed