SCHEMBL8399456

SCHEMBL8399456

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

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.44
MAPT P10636 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL8401411 0.85 PKM (0.46)
SCHEMBL9084289 0.85 THRB (0.47) THRBMAPTTDP1SMN1; SMN2
SCHEMBL9158313 0.83
SCHEMBL8786216 0.80 SMN1; SMN2 (0.45) MAPTTDP1SMN1; SMN2
SCHEMBL8402590 0.78 TP53 (0.42) THRBMAPTSMN1; SMN2
SCHEMBL8202905 0.76 NPC1 (0.46) SMN1; SMN2
SCHEMBL8196513 0.76 NPC1 (0.46) SMN1; SMN2
SCHEMBL8401455 0.75 LMNA (0.47) MAPTSMN1; SMN2
SCHEMBL9082748 0.75 PKM (0.47) MAPTSMN1; SMN2
SCHEMBL9157930 0.74

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