SCHEMBL7146473

SCHEMBL7146473

O=S1(=O)N=C(c2ccc(Cl)cc2)c2ccc(OCCCCC3CCNC3)cc21

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LSS P48449 1/20 0.41
ITGB3 P05106 4/20 0.38
ITGA2B P08514 4/20 0.38
NPY1R P25929 10/20 0.36
ACP1 P24666 1/20 0.35
PRKCZ Q05513 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
KDM1A O60341 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
SCHEMBL7151209 0.94 ITGB3 (0.42) LSSITGB3ITGA2BNPY1R
SCHEMBL7148900 0.86 LSS (0.42) LSSNPY1R
SCHEMBL7149720 0.80 LSS (0.51) LSSITGB3ITGA2B
SCHEMBL5038215 0.79 LSS (0.49) LSS
SCHEMBL5140118 0.78 LSS (0.54) LSS
SCHEMBL7142592 0.76 LSS (0.52) LSS
SCHEMBL5040046 0.76 HRH3 (0.51)
SCHEMBL5039980 0.76 HRH3 (0.54)
SCHEMBL5040208 0.75 HRH3 (0.56)
SCHEMBL5140409 0.75 LSS (0.52) LSS

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-1334094-A1 CHOLESTEROL LOWERING BENZO[B]THIOPHENES AND BENZO[D]ISOTHIAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2003-08-13 EP disclosed
WO-2002036584-A1 CHOLESTEROL LOWERING BENZO`B! THIOPHENES AND BENZO`D! ISOTHIAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2002-05-10 WO disclosed