SCHEMBL7167944

SCHEMBL7167944

CC[As](CC)CCCC#Cc1ccc2c(-c3ccc(C(F)(F)F)cc3)c(C)sc2c1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ LSS P48449 1/20 0.32
▸ ESR1 P03372 1/20 0.32

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
SCHEMBL7144742 0.87 ESR1 (0.35) LSSESR1
SCHEMBL5043318 0.86 LSS (0.38) LSSESR1
SCHEMBL5038830 0.84 LSS (0.45) LSSESR1
SCHEMBL5045748 0.83 ESR1 (0.37) LSSESR1
SCHEMBL5038354 0.83 LSS (0.36) LSSESR1
SCHEMBL5038356 0.82 ESR1 (0.31) ESR1
SCHEMBL5045659 0.81 ESR1 (0.38) LSSESR1
SCHEMBL5038989 0.81 ESR1 (0.36) ESR1
SCHEMBL5043626 0.81 LSS (0.42) LSSESR1
SCHEMBL5038033 0.81 LSS (0.54) LSSESR1

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
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