SCHEMBL4783312

SCHEMBL4783312

CCN(CCCC[C@@H](Nc1ccc(F)c(C)c1)C(=O)NO)c1ccc(F)cc1

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.52
KCNH2 Q12809 2/20 0.52

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
SCHEMBL4741156 0.83 CYP2D6 (0.56) CYP2D6KCNH2
SCHEMBL4741198 0.82 CYP2D6 (0.56) CYP2D6KCNH2
SCHEMBL4739492 0.81 CYP2D6 (0.52) CYP2D6KCNH2
SCHEMBL8164728 0.81 CYP2D6 (0.52) CYP2D6KCNH2
SCHEMBL4742059 0.81 CYP2D6 (0.52) CYP2D6KCNH2
SCHEMBL4739483 0.80 CYP2D6 (0.53) CYP2D6KCNH2
SCHEMBL4741162 0.79 CYP2D6 (0.51) CYP2D6KCNH2
SCHEMBL4738502 0.78 CYP2D6 (0.81) CYP2D6KCNH2
SCHEMBL4783319 0.77 CYP2D6 (0.67) CYP2D6KCNH2
SCHEMBL8167416 0.77 CYP2D6 (0.65) CYP2D6KCNH2

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-2008094592-A1 HYDROXAMIC ACID DERIVATIVES OF ANILINE USEFUL AS THERAPEUTIC AGENTS FOR TREATING ANTHRAX POISONING PANTHERA BIOPHARNA, LLC (US) 2008-08-07 WO disclosed