SCHEMBL9569772

SCHEMBL9569772

O=C(Nc1ccc(Cl)cc1)NS(=O)(=O)c1cc2ccccc2[nH]1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.44
STING1 Q86WV6 1/20 0.44
CNR1 P21554 4/20 0.43
ALDH1A1 P00352 1/20 0.43
IDH1 O75874 3/20 0.43
NPC1 O15118 1/20 0.43
LMNA P02545 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GRIK1 P39086 1/20 0.43
MAPT P10636 1/20 0.42
FBP1 P09467 1/20 0.42
MEN1 O00255 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
KMT2A Q03164 1/20 0.42
CA9 Q16790 1/20 0.42
CCKAR P32238 1/20 0.42

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
SCHEMBL350078 0.79 GRIK1 (0.64) STING1CNR1NPC1LMNARAB9A
SCHEMBL10568558 0.77 GAA (0.45) CA2CNR1ALDH1A1LMNACCKAR
SCHEMBL6923052 0.76 CA2 (0.54) CA2CNR1MAPTCCKAR
SCHEMBL9529388 0.74 LMNA (0.63) CA2ALDH1A1LMNAMAPTFBP1
SCHEMBL16627058 0.73 NPC1 (0.78) ALDH1A1NPC1LMNARAB9ASMN1; SMN2
SCHEMBL7983231 0.72 HDAC1 (0.48) CA2CNR1ALDH1A1IDH1LMNA
SCHEMBL7997094 0.72 CCR2 (0.50) CA2FBP1CA12CA1CA9
SCHEMBL2175114 0.72 FBP1 (0.58) FBP1
SCHEMBL9486495 0.72 CA12 (0.66) CA2ALDH1A1LMNARAB9ASMN1; SMN2
SCHEMBL9569774 0.72 ESR1 (0.52) CA2NPC1RAB9AMAPTFBP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0560554-A2 Antitumor compositions and methods of treatment ELI LILLY AND COMPANY (US) 1993-09-15 EP disclosed
US-5169860-A Benzofuran or benzothiophene arylsulfonylureas ELI LILLY AND COMPANY (US) 1992-12-08 US disclosed