SCHEMBL8401411

SCHEMBL8401411

Cc1ccccc1-c1c(NC(=O)Nc2ccc(F)cc2F)oc2ccc(Cl)cc12

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.46

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
SCHEMBL8202905 0.91 NPC1 (0.46) PKM
SCHEMBL8196513 0.90 NPC1 (0.46) PKM
SCHEMBL8398923 0.88 GABRP (0.39)
SCHEMBL9158313 0.88
SCHEMBL8399456 0.85 THRB (0.44)
SCHEMBL9260108 0.85 SMN1; SMN2 (0.48) PKM
SCHEMBL8188031 0.85 PKM (0.46) PKM
SCHEMBL8189278 0.83 PKM (0.47) PKM
SCHEMBL9082748 0.83 PKM (0.47) PKM
SCHEMBL8197661 0.81 PKM (0.49) PKM

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5929107-A INHIBITORS OF ACYL-COA:CHOLESTEROL ACYLTRANSFERASE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-07-27 US disclosed
US-5492929-A ENZYME INHIBITORS, ANTICHOLESTEROL AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-02-20 US disclosed
EP-0602598-A1 3-Phenylindolyl-, -benzofuranyl- and -benzothienyl- alkylcarboxanilides, their production and use Takeda Chemical Industries, Ltd. (JP) 1994-06-22 EP disclosed