SCHEMBL1957396

SCHEMBL1957396

CC(Oc1ccc(N2CCC3(CCNCC3)C2=O)cc1)C(F)(F)F

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 19/20 0.61
EGLN1 Q9GZT9 1/20 0.45

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
SCHEMBL1944828 1.00 LIPE (0.61) LIPEEGLN1
SCHEMBL610547 1.00 LIPE (0.61) LIPEEGLN1
SCHEMBL11679 0.87 LIPE (0.64) LIPEEGLN1
SCHEMBL11294 0.87 LIPE (0.64) LIPEEGLN1
SCHEMBL9889 0.87 LIPE (0.64) LIPEEGLN1
SCHEMBL5787 0.85 LIPE (0.62) LIPE
SCHEMBL1590925 0.85 LIPE (0.62) LIPEEGLN1
SCHEMBL12068 0.85 LIPE (0.62) LIPEEGLN1
SCHEMBL11682 0.85 LIPE (0.62) LIPE
SCHEMBL11902 0.85 LIPE (0.62) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2507239-A1 AZACYCLIC SPIRO DERIVATIVES F. Hoffmann-La Roche AG (CH) 2012-10-10 EP disclosed
WO-2011067166-A1 AZACYCLIC SPIRO DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2011-06-09 WO disclosed