SCHEMBL14748113

SCHEMBL14748113

CCC(C)N1CCN(C(=O)OC(C)(C)C)[C@H](C)C1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR1H3 Q13133 4/20 0.39
NR1H2 P55055 4/20 0.39
SETD7 Q8WTS6 2/20 0.39
GPR119 Q8TDV5 2/20 0.39
MAP4K4 O95819 1/20 0.38
POLB P06746 1/20 0.35
HDAC1 Q13547 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL17067941 1.00 NR1H3 (0.39) NR1H3NR1H2SETD7GPR119MAP4K4
SCHEMBL18500417 0.87 SETD7 (0.39) NR1H3NR1H2SETD7GPR119MAP4K4
SCHEMBL21280228 0.87 SETD7 (0.39) NR1H3NR1H2SETD7GPR119MAP4K4
SCHEMBL18500416 0.87 SETD7 (0.39) NR1H3NR1H2SETD7GPR119MAP4K4
SCHEMBL12349924 0.85 HRH3 (0.43) NR1H3NR1H2SETD7GPR119MAP4K4
SCHEMBL15333158 0.85 HRH3 (0.43) NR1H3NR1H2SETD7GPR119MAP4K4
SCHEMBL15332364 0.85 HRH3 (0.43) NR1H3NR1H2SETD7GPR119MAP4K4
SCHEMBL18781018 0.83 SETD7 (0.40) NR1H3NR1H2SETD7GPR119MAP4K4
SCHEMBL25785236 0.83 SETD7 (0.40) NR1H3NR1H2SETD7GPR119MAP4K4
SCHEMBL25873048 0.82 CTSK (0.41) NR1H3NR1H2

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-2565193-A1 Compositions and methods for inhibition of the JAK pathway Rigel Pharmaceuticals, Inc. (US) 2013-03-06 EP disclosed