SCHEMBL13634209

SCHEMBL13634209

CC[C@H]1COCCN1C(N)=O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 4/20 0.41
PDK2 Q15119 1/20 0.40
PDK3 Q15120 1/20 0.40
PRMT5 O14744 3/20 0.38
KDM4E B2RXH2 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
HTT P42858 1/20 0.33
TSHR P16473 1/20 0.33
DPP4 P27487 1/20 0.32
RECQL P46063 1/20 0.31
FKBP1A P62942 1/20 0.31

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
SCHEMBL29921251 1.00 PDK1 (0.41) PDK1PDK2PDK3PRMT5KDM4E
SCHEMBL30354026 0.86 PDK1 (0.39) PDK1PDK2PDK3KDM4ECA12
SCHEMBL17572003 0.84 PDK1 (0.42) PDK1PDK2PDK3PRMT5L3MBTL1
SCHEMBL17893278 0.84 PDK1 (0.42) PDK1PDK2PDK3PRMT5L3MBTL1
SCHEMBL17572807 0.84 PDK1 (0.42) PDK1PDK2PDK3PRMT5L3MBTL1
SCHEMBL15731644 0.84 PDK1 (0.42) PDK1PDK2PDK3PRMT5L3MBTL1
SCHEMBL13162310 0.81 PDK1 (0.61) PDK1PDK2PDK3KDM4EL3MBTL1
SCHEMBL21655140 0.81 PDK1 (0.47) PDK1PDK2PDK3PRMT5L3MBTL1
SCHEMBL30732668 0.79 PDK1 (0.38) PDK1PDK2PDK3KDM4EL3MBTL1
SCHEMBL19480263 0.79 PDK1 (0.39) PDK1PDK2PDK3PRMT5L3MBTL1

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-8304547-B2 Azolecarboxamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2012-11-06 US disclosed