SCHEMBL27468675

SCHEMBL27468675

O=S(=O)(O)c1cc(Br)cc(I)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.39
FYN P06241 1/20 0.39
ING2 Q9H160 1/20 0.38
TSHR P16473 3/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
LMNA P02545 1/20 0.33
ALDH1A1 P00352 4/20 0.32
HSD17B10 Q99714 3/20 0.32
NT5E P21589 3/20 0.32
TDP1 Q9NUW8 1/20 0.32
CASP6 P55212 3/20 0.32
ACP1 P24666 2/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
NSD2 O96028 2/20 0.31
GAA P10253 1/20 0.31
PLCG1 P19174 1/20 0.31
DNMT1 P26358 1/20 0.31

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
SCHEMBL27481037 0.84 LCK (0.46) LCKFYNING2TSHRSMN1; SMN2
SCHEMBL197184 0.84 LCK (0.46) LCKFYNING2TSHRSMN1; SMN2
SCHEMBL198861 0.84 LCK (0.46) LCKFYNING2TSHRSMN1; SMN2
SCHEMBL11078671 0.81 LCK (0.44) LCKFYNING2TSHRSMN1; SMN2
SCHEMBL4452071 0.77 LCK (0.41) LCKFYNING2TSHRSMN1; SMN2
SCHEMBL17262659 0.76 LMNA (0.44) LCKFYNING2TSHRSMN1; SMN2
SCHEMBL17262653 0.76 LMNA (0.44) LCKFYNING2TSHRSMN1; SMN2
SCHEMBL17262651 0.74 ALDH1A1 (0.50) LCKFYNING2TSHRSMN1; SMN2
SCHEMBL1510131 0.74 LCK (0.39) LCKFYNING2TSHRSMN1; SMN2
SCHEMBL17262657 0.74 ALDH1A1 (0.50) LCKFYNING2TSHRSMN1; 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
CN-1131153-A 1-oxy-2-(phenylsulfonamido-) amyl piperidine derivant, its preparation method and medicinal use thereof SYNTHELABO (FR) 1996-09-18 CN disclosed