SCHEMBL9079963

SCHEMBL9079963

COC(=O)c1ccccc1S(=O)(=O)NC(=O)Nc1nc(C)cc(CO)n1

nearest known ligand 0.82

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.44
GAA P10253 1/20 0.44
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA5A P35218 1/20 0.41
CA9 Q16790 1/20 0.41
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 2/20 0.41
THRB P10828 1/20 0.41
SLC40A1 Q9NP59 1/20 0.41
HSD17B10 Q99714 1/20 0.40
BRD4 O60885 1/20 0.40

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
SCHEMBL10901088 0.91 NPC1 (0.43) NPC1GAACA1CA2CA5A
Sulfometuron Methyl SCHEMBL9137833 0.90 GAA (0.50) NPC1GAACA1CA2CA5A
Sulfometuron Methyl SCHEMBL54998 0.90 GAA (0.50) NPC1GAACA1CA2CA5A
Sulfometuron Methyl SCHEMBL27545620 0.90 GAA (0.50) NPC1GAACA1CA2CA5A
SCHEMBL10566429 0.89 LMNA (0.43) NPC1GAACA1CA2CA9
Sulfometuron Methyl SCHEMBL15524982 0.89 GAA (0.49) NPC1GAACA1CA2CA5A
Sulfometuron Methyl SCHEMBL2438199 0.86 NPC1 (0.49) NPC1GAACA1CA2CA5A
SCHEMBL9419172 0.85 GAA (0.52) NPC1GAACA1CA2CA5A
SCHEMBL9079811 0.84 NPC1 (0.47) NPC1GAACA1CA2CA5A
SCHEMBL10455401 0.82 GAA (0.43) NPC1GAACA1CA2CA5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0554240-B1 EXPRESSION OF HERBICIDE METABOLIZING CYTOCHROMES P450 DU PONT (US) 1996-01-17 EP disclosed
US-5349127-A Expression of herbicide metabolizing cytochromes P450 E. I. DU PONT DE NEMOURS AND COMPANY (US) 1994-09-20 US disclosed
EP-0554240-A1 EXPRESSION OF HERBICIDE METABOLIZING CYTOCHROMES P450. DU PONT (US) 1993-08-11 EP disclosed
US-5212296-A DNA sequences E. I. DU PONT DE NEMOURS AND COMPANY (US) 1993-05-18 US disclosed
WO-1991003561-A1 EXPRESSION OF HERBICIDE METABOLIZING CYTOCHROMES P450 E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-03-21 WO disclosed