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SCHEMBL5799422

SCHEMBL5799422

CCN(CCC#N)C1(C2CN(c3c(F)cc4c(=O)[nH]c(=O)n(C5CC5)c4c3C)C2)CC1.CCN(CCC#N)CC1CCN(c2c(F)cc3c(=O)n(N)c(=O)n(C4CC4)c3c2OC)C1

nearest known ligand 0.52

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 6/20 0.34

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
SCHEMBL5800341 0.86 KCNH2 (0.39) KCNH2
SCHEMBL5459058 0.85 KCNH2 (0.44) KCNH2
SCHEMBL5469146 0.84 KCNH2 (0.36) KCNH2
SCHEMBL5459785 0.84 KCNH2 (0.43) KCNH2
SCHEMBL5467119 0.84 KCNH2 (0.40) KCNH2
SCHEMBL5459018 0.84 KCNH2 (0.35) KCNH2
SCHEMBL5801490 0.83 KCNH2 (0.32) KCNH2
SCHEMBL5455471 0.83 KCNH2 (0.39) KCNH2
SCHEMBL5454203 0.83 KCNH2 (0.41) KCNH2
SCHEMBL5452041 0.82 KCNH2 (0.42) KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1687296-A1 ANTIBACTERIAL AMINOQUINAZOLIDINEDIONE DERIVATIVES Warner-Lambert Company LLC (US) 2006-08-09 — — EP claimed
WO-2005049605-A1 ANTIBACTERIAL AMINOQUINAZOLIDINEDIONE DERIVATIVES WARNER-LAMBERT COMPANY LLC (US) 2005-06-02 — — WO claimed
EP-1687296-A1 ANTIBACTERIAL AMINOQUINAZOLIDINEDIONE DERIVATIVES Warner-Lambert Company LLC (US) 2006-08-09 — — EP disclosed
WO-2005049605-A1 ANTIBACTERIAL AMINOQUINAZOLIDINEDIONE DERIVATIVES WARNER-LAMBERT COMPANY LLC (US) 2005-06-02 — — WO disclosed