SCHEMBL6409175

SCHEMBL6409175

CC(C)(C)OC(=O)N1CCN(c2nc3c([nH]2)C(=O)N(COCc2ccccc2)NC3)CC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.47
NAMPT P43490 1/20 0.40
PRMT5 O14744 4/20 0.40
SLC2A1 P11166 1/20 0.40
CKS1B P61024 1/20 0.40
SKP1 P63208 1/20 0.40
SKP2 Q13309 1/20 0.40
TLR9 Q9NR96 4/20 0.40
TLR7 Q9NYK1 2/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KIT P10721 2/20 0.39
FLT3 P36888 1/20 0.39
GPR119 Q8TDV5 1/20 0.39
MGLL Q99685 1/20 0.39
PTPN11 Q06124 1/20 0.38

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
SCHEMBL2961094 0.75 ACHE (0.45) ACHENAMPTPRMT5SLC2A1CKS1B
SCHEMBL5002349 0.72 CHRM2 (0.53) ACHEMEN1KMT2AGPR119
SCHEMBL20897769 0.69 HTR3A (0.62) MGLL
SCHEMBL1946774 0.68 GRM5 (0.64) ACHE
SCHEMBL24265269 0.67 GPR119 (0.56) ACHEPRMT5CKS1BSKP1SKP2
SCHEMBL29574249 0.67 GPR119 (0.56) ACHEPRMT5CKS1BSKP1SKP2
SCHEMBL20767890 0.67 NAMPT (0.64) ACHENAMPTCKS1BSKP1SKP2
SCHEMBL1842426 0.67 MEN1 (0.61) ACHEMEN1KMT2AGPR119
SCHEMBL13217691 0.67 ACHE (0.49) ACHENAMPTPRMT5SLC2A1CKS1B
SCHEMBL26483101 0.67 ACHE (0.53) ACHESLC2A1CKS1BSKP1SKP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1514552-A1 NOVEL FUSED IMIDAZOLE DERIVATIVE Eisai Co., Ltd. (JP) 2005-03-16 EP disclosed