SCHEMBL16457372

SCHEMBL16457372

CC(C)(C)OC(=O)N1CCC(c2nc(CC(F)(F)F)cn2CCO)CC1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.42
MAPT P10636 2/20 0.42
KDM4E B2RXH2 1/20 0.42
TRPV3 Q8NET8 2/20 0.41
CNR1 P21554 1/20 0.41
DPP4 P27487 1/20 0.39
GPR119 Q8TDV5 5/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
HPGDS O60760 1/20 0.38
GAA P10253 1/20 0.38
P2RY14 Q15391 1/20 0.38

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
SCHEMBL16457344 0.89 PRKCB (0.43) THRBMAPTKDM4ETRPV3DPP4
SCHEMBL9927822 0.88 KDM4E (0.44) THRBMAPTKDM4ETRPV3CNR1
SCHEMBL16457414 0.88 HDAC4 (0.40) THRBMAPTKDM4ETRPV3DPP4
SCHEMBL16457229 0.86 GPR119 (0.40) THRBMAPTKDM4EGPR119
SCHEMBL16456980 0.86 THRB (0.42) THRBMAPTKDM4ETRPV3CNR1
SCHEMBL16457196 0.86 KDM4E (0.42) THRBMAPTKDM4ETRPV3CNR1
SCHEMBL16457324 0.85 GPR119 (0.45) THRBMAPTKDM4ETRPV3CNR1
SCHEMBL16457697 0.84 KDM4E (0.44) THRBMAPTKDM4ETRPV3CNR1
SCHEMBL1662349 0.84 THRB (0.36) THRBMAPTKDM4ETRPV3DPP4
SCHEMBL16457034 0.84 TRPV3 (0.45) THRBMAPTKDM4ETRPV3CNR1

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
EP-2491032-B1 AKT INHIBITORS LILLY CO ELI (US) 2014-04-16 EP disclosed