SCHEMBL11328699

SCHEMBL11328699

O=S(=O)(O)c1ccc(NS(=O)(=O)C(F)(F)F)cc1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 11/20 0.68
CA1 P00915 7/20 0.60
PTPN1 P18031 1/20 0.59
MAPK1 P28482 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
PTPN11 Q06124 1/20 0.58
KIF11 P52732 1/20 0.45
LMNA P02545 1/20 0.43
HSPD1 P10809 1/20 0.42
HSPE1 P61604 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42
NT5E P21589 1/20 0.42
PPARG P37231 1/20 0.42
PPARA Q07869 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
SCHEMBL13893214 0.81 CA1 (0.72) CA2CA1
SCHEMBL10626668 0.81 CA2 (0.68) CA2CA1PTPN1MAPK1SMN1; SMN2
SCHEMBL7525890 0.81 CA2 (0.68) CA2CA1PTPN1MAPK1SMN1; SMN2
SCHEMBL3155581 0.80 PTPN1 (0.63) CA2CA1PTPN1MAPK1SMN1; SMN2
SCHEMBL10623902 0.78 CA2 (0.66) CA2CA1PTPN1MAPK1SMN1; SMN2
SCHEMBL7527132 0.78 PTPN1 (0.66) CA2CA1PTPN1MAPK1SMN1; SMN2
SCHEMBL7524156 0.76 PTPN1 (0.63) CA2CA1PTPN1MAPK1SMN1; SMN2
SCHEMBL6881190 0.76 PTPN1 (0.63) CA2CA1PTPN1MAPK1SMN1; SMN2
SCHEMBL4049597 0.76 CA2 (0.67) CA2CA1PTPN1MAPK1SMN1; SMN2
SCHEMBL11121097 0.76 PTPN11 (0.72) CA2CA1PTPN1MAPK1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4288592-A Process for preparing amides by reaction in presence of molecular sieve AMERICAN CYANAMID COMPANY (US) 1981-09-08 US disclosed