SCHEMBL14217210

SCHEMBL14217210

Cc1ncccc1S(=O)(=O)N1CCC2(CCN(c3ccc(OC(F)(F)F)cc3)C2=O)CC1

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 17/20 0.72
EGLN1 Q9GZT9 3/20 0.47

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
SCHEMBL3752817 0.90 LIPE (0.72) LIPEEGLN1
SCHEMBL748171 0.90 LIPE (0.68) LIPEEGLN1
SCHEMBL744867 0.89 LIPE (0.71) LIPEEGLN1
SCHEMBL745795 0.89 LIPE (0.77) LIPE
SCHEMBL747636 0.89 LIPE (0.67) LIPEEGLN1
SCHEMBL746926 0.89 LIPE (0.67) LIPEEGLN1
SCHEMBL3747137 0.88 LIPE (0.71) LIPEEGLN1
SCHEMBL3749913 0.85 LIPE (0.65) LIPE
SCHEMBL3745550 0.85 LIPE (0.70) LIPEEGLN1
SCHEMBL743640 0.85 LIPE (0.79) LIPE

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
US-8329904-B2 Azacyclic derivatives HOFFMANN-LA ROCHE INC. (US) 2012-12-11 US disclosed