SCHEMBL6528178

SCHEMBL6528178

Cc1c(N2CCC(O)C(CO)C2)cc(N)c2c(=O)[nH]c(=O)n(C3CC3)c12

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EEF2K O00418 1/20 0.33
TK1 P04183 2/20 0.32
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL6370154 0.82 TK1 (0.36) EEF2KTK1ALDH1A1
SCHEMBL6529317 0.80 TPH1 (0.31)
SCHEMBL6671058 0.79 KCNH2 (0.33)
SCHEMBL5822717 0.78 KCNH2 (0.33) EEF2K
SCHEMBL6372782 0.77 KCNH2 (0.41)
SCHEMBL5458063 0.77 KCNH2 (0.35)
SCHEMBL6671593 0.77 KCNH2 (0.32)
SCHEMBL5798520 0.77 KCNH2 (0.32)
SCHEMBL5459698 0.75 KCNH2 (0.32)
SCHEMBL5455611 0.75 KCNH2 (0.34)

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
WO-2005026145-A2 QUINOLONE ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY LLC (US) 2005-03-24 WO disclosed