SCHEMBL4448090

SCHEMBL4448090

O=S(=O)(O)c1cc(Cl)cc(S(=O)(=O)c2cc(Cl)cc(S(=O)(=O)O)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
CYP3A4 P08684 1/20 0.42
MAPK1 P28482 1/20 0.42
LCK P06239 1/20 0.41
FYN P06241 1/20 0.41
ING2 Q9H160 1/20 0.40
TSHR P16473 3/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ACP1 P24666 1/20 0.36
FABP4 P15090 2/20 0.36
HSD11B1 P28845 1/20 0.36
LMNA P02545 1/20 0.36
AKR1B1 P15121 1/20 0.35
NT5E P21589 2/20 0.34
HSD17B10 Q99714 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
FBP1 P09467 1/20 0.34
CNR1 P21554 1/20 0.34

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
SCHEMBL11409650 0.93 LCK (0.46) ALDH1A1CYP3A4MAPK1LCKFYN
SCHEMBL197473 0.87 LCK (0.46) ALDH1A1LCKFYNING2TSHR
Hydrochloric Acid SCHEMBL27989889 0.85 LCK (0.44) ALDH1A1LCKFYNING2TSHR
SCHEMBL4304711 0.85 LCK (0.44) ALDH1A1LCKFYNING2TSHR
SCHEMBL1958683 0.82 ALDH1A1 (0.52) ALDH1A1CYP3A4MAPK1TSHRMEN1
SCHEMBL17262670 0.79 LMNA (0.44) ALDH1A1CYP3A4LCKFYNING2
SCHEMBL219222 0.79 LCK (0.57) ALDH1A1LCKFYNING2TSHR
SCHEMBL1510131 0.77 LCK (0.39) ALDH1A1LCKFYNING2TSHR
SCHEMBL8165416 0.77 ALDH1A1 (0.50) ALDH1A1CYP3A4LCKFYNING2
SCHEMBL4452071 0.76 LCK (0.41) ALDH1A1LCKFYNING2TSHR

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-20090269645-A1 POLYMER, POLYMER ELECTROLYTE AND FUEL CELL USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-10-29 US disclosed