SCHEMBL14730263

SCHEMBL14730263

Cc1ccc(F)c([C@H]2CN(c3ncc(C(=O)N(C)C4CCN(c5nc(C6CC6)no5)CC4)cn3)C[C@@H]2NC(=O)OC(C)(C)C)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.35
PDK2 Q15119 2/20 0.34
SYK P43405 2/20 0.32
EIF2AK4 Q9P2K8 1/20 0.32
NR1H2 P55055 3/20 0.31
NR1H3 Q13133 2/20 0.31
BRAF P15056 2/20 0.31
HDAC4 P56524 2/20 0.31
HDAC6 Q9UBN7 2/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC10 Q969S8 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC9 Q9UKV0 1/20 0.31
HDAC5 Q9UQL6 1/20 0.31
NCOR2 Q9Y618 1/20 0.31
NTRK1 P04629 2/20 0.31
VNN1 O95497 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
SCHEMBL14730312 0.95 GPR119 (0.36) GPR119EIF2AK4NR1H2NR1H3BRAF
SCHEMBL14730219 0.92 PDK2 (0.36) GPR119PDK2SYKEIF2AK4NR1H2
SCHEMBL14730216 0.92 GPR119 (0.33) GPR119PDK2SYKEIF2AK4NR1H2
SCHEMBL14730256 0.91 PDK2 (0.34) GPR119PDK2SYKEIF2AK4NR1H2
SCHEMBL14730327 0.91 GPR119 (0.35) GPR119PDK2SYKEIF2AK4NR1H2
SCHEMBL14730175 0.91 SYK (0.32) PDK2SYKEIF2AK4NR1H2NR1H3
SCHEMBL14730202 0.87 NTRK1 (0.35) GPR119EIF2AK4NR1H2NR1H3BRAF
SCHEMBL14730207 0.87 NTRK1 (0.34) EIF2AK4NR1H2NR1H3BRAFHDAC4
SCHEMBL14730252 0.86 GPR119 (0.37) GPR119SYKEIF2AK4NR1H2NR1H3
SCHEMBL14730179 0.86 GPR119 (0.34) GPR119NR1H2NTRK1

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
WO-2013026587-A1 1,4 DISUBSTITUTED PYRROLIDINE - 3 - YL -AMINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2013-02-28 WO disclosed