SCHEMBL6687899

SCHEMBL6687899

COc1ccc2nccc(C(O)CN3CC[C@H](NC(=O)OC(C)(C)C)C[C@H]3C(F)(F)F)c2n1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 5/20 0.49
KCNH2 Q12809 5/20 0.46
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
KDM4D Q6B0I6 1/20 0.37
MAP4K4 O95819 1/20 0.36

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
SCHEMBL3254324 1.00 SLC2A1 (0.49) SLC2A1KCNH2JAK2JAK1KDM4D
SCHEMBL3250355 1.00 SLC2A1 (0.49) SLC2A1KCNH2JAK2JAK1KDM4D
SCHEMBL3254329 1.00 SLC2A1 (0.49) SLC2A1KCNH2JAK2JAK1KDM4D
SCHEMBL3250358 1.00 SLC2A1 (0.49) SLC2A1KCNH2JAK2JAK1KDM4D
SCHEMBL5726714 0.86 SLC2A1 (0.61) SLC2A1KCNH2
SCHEMBL5264092 0.83 SLC2A1 (0.48) SLC2A1KCNH2JAK2JAK1MAP4K4
SCHEMBL3249089 0.82 SLC2A1 (0.46) SLC2A1KCNH2
SCHEMBL3247718 0.82 SLC2A1 (0.46) SLC2A1KCNH2
SCHEMBL3250001 0.82 SLC2A1 (0.46) SLC2A1KCNH2
SCHEMBL3246385 0.82 SLC2A1 (0.46) SLC2A1KCNH2

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-1470125-A1 AMINOPIPERIDINE DERIVATIVES GLAXO GROUP LIMITED (GB) 2004-10-27 EP disclosed
WO-2003064421-A1 AMINOPIPERIDINE DERIVATIVES GLAXO GROUP LIMITED (GB) 2003-08-07 WO disclosed