SCHEMBL5559650

SCHEMBL5559650

O=S(=O)(Cl)Cl.O=S(=O)(Cl)c1cccs1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.50
CYP2C19 P33261 2/20 0.50
PKM P14618 2/20 0.50
CYP2D6 P10635 1/20 0.50
F2 P00734 1/20 0.47
PRSS1 P07477 1/20 0.47
PRSS2 P07478 1/20 0.47
PRSS3 P35030 1/20 0.47
POLB P06746 2/20 0.44
CYP3A4 P08684 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ALDH1A1 P00352 4/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HSD17B10 Q99714 1/20 0.42
LOX P28300 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL15907 0.98
SCHEMBL6896419 0.82 MAPT (0.47) CYP2C9CYP2C19PKMCYP2D6POLB
SCHEMBL8193497 0.79
SCHEMBL3041710 0.79 HTR6 (0.50) CYP2C9CYP2C19PKMCYP2D6F2
SCHEMBL6825084 0.78 CYP2D6 (0.49) CYP2C9CYP2C19CYP2D6MAPTHPGD
SCHEMBL1336037 0.77 LOX (0.60) CYP2C9CYP2C19PKMCYP2D6F2
SCHEMBL15880570 0.76 CYP2C9 (0.36) CYP2C9CYP2C19PKMCYP2D6F2
Hydrochloric Acid SCHEMBL8128267 0.76 LMNA (0.45) CYP2C9CYP2C19PKMCYP2D6MAPT
Hydrochloric Acid SCHEMBL28533417 0.75 LOX (0.58) CYP2C9CYP2C19PKMCYP2D6F2
SCHEMBL329263 0.75

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
EP-1658288-B1 2-AMINO-5-BENZOYLTHIAZOLE NPY ANTAGONISTS HOFFMANN LA ROCHE (CH) 2007-12-05 EP disclosed