SCHEMBL7149946

SCHEMBL7149946

FC(F)(F)c1ccc(-c2nsc3cc(OCCCCC4CCNCC4)ccc23)cc1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LSS P48449 9/20 0.46
KDM1A O60341 2/20 0.44
MAOB P27338 2/20 0.44
ITGB3 P05106 3/20 0.39
ITGA2B P08514 3/20 0.39
PRMT5 O14744 1/20 0.38
CHEK1 O14757 1/20 0.37
F10 P00742 1/20 0.35
CHEK2 O96017 1/20 0.35
PPARD Q03181 1/20 0.35
PPARA Q07869 1/20 0.35

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
SCHEMBL7150712 0.89 LSS (0.48) LSSKDM1AMAOBPPARDPPARA
SCHEMBL7149010 0.88 LSS (0.59) LSSKDM1AITGB3ITGA2BCHEK1
SCHEMBL7152745 0.88 LSS (0.47) LSSITGB3ITGA2BCHEK1CHEK2
SCHEMBL7150699 0.83 LSS (0.46) LSS
SCHEMBL7145197 0.83 LSS (0.57) LSSKDM1AITGB3ITGA2B
SCHEMBL7148486 0.81 LSS (0.49) LSSPPARDPPARA
SCHEMBL5035448 0.81 LSS (0.54) LSSMAOBPPARDPPARA
SCHEMBL7152838 0.80 LSS (0.55) LSSKDM1ACHEK1
SCHEMBL5039022 0.79 LSS (0.58) LSS
SCHEMBL5045466 0.78 LSS (0.64) LSSMAOB

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