SCHEMBL7148486

SCHEMBL7148486

NCCCCOc1ccc2c(-c3ccc(C(F)(F)F)cc3)nsc2c1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LSS P48449 10/20 0.49
PPARD Q03181 1/20 0.38
PPARA Q07869 1/20 0.38
CACNA1B Q00975 1/20 0.37
SLC7A5 Q01650 3/20 0.36
AURKA O14965 1/20 0.36
RPS6KB1 P23443 1/20 0.36
MKNK1 Q9BUB5 1/20 0.36
MKNK2 Q9HBH9 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
NOS1 P29475 1/20 0.36

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
SCHEMBL5035448 0.89 LSS (0.54) LSSPPARDPPARANOS1
SCHEMBL5039022 0.86 LSS (0.58) LSSCACNA1B
SCHEMBL5035491 0.84 LSS (0.68) LSS
SCHEMBL5043138 0.84 LSS (0.68) LSSPPARDPPARACACNA1B
SCHEMBL5038777 0.84 LSS (0.65) LSS
SCHEMBL5043701 0.84 LSS (0.65) LSS
SCHEMBL5045466 0.83 LSS (0.64) LSS
SCHEMBL5035392 0.83 LSS (0.66) LSS
SCHEMBL7150712 0.82 LSS (0.48) LSSPPARDPPARA
SCHEMBL5035262 0.82 LSS (0.63) 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