SCHEMBL6528433

SCHEMBL6528433

Cc1ccc(Nc2c(F)c(N3CCC(CO)C(O)C3)c(C)c3c2c(=O)[nH]c(=O)n3C2CC2)c2c(=O)[nH]c(=O)[nH]c12

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 1/20 0.31

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
SCHEMBL6529057 0.94
SCHEMBL6531591 0.86 PRKDC (0.32) PRKDC
SCHEMBL6671058 0.74 KCNH2 (0.33)
SCHEMBL6672536 0.74 KCNH2 (0.34)
SCHEMBL6376660 0.72 KCNH2 (0.41)
SCHEMBL6686031 0.72 KCNH2 (0.35)
SCHEMBL6670991 0.71 KCNH2 (0.34)
SCHEMBL6673140 0.70 KCNH2 (0.35)
SCHEMBL6668343 0.70 KCNH2 (0.33)
SCHEMBL6671593 0.70 KCNH2 (0.32)

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 claimed