SCHEMBL470535

SCHEMBL470535

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

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.33
CKS1B P61024 1/20 0.32
SKP1 P63208 1/20 0.32
SKP2 Q13309 1/20 0.32
GRM4 Q14833 1/20 0.31
EIF2AK4 Q9P2K8 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
MAP3K5 Q99683 2/20 0.31
RET P07949 4/20 0.30
SYK P43405 1/20 0.30
ACACB O00763 1/20 0.30

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
SCHEMBL463066 0.94 NR1H2 (0.33) NR1H2CKS1BSKP1SKP2GRM4
SCHEMBL12064814 0.92 NR1H2 (0.33) NR1H2CKS1BSKP1SKP2GRM4
SCHEMBL12064983 0.92 GPR119 (0.36) NR1H2GRM4LMNAMAPT
SCHEMBL470580 0.91 NR1H2 (0.33) NR1H2CKS1BSKP1SKP2GRM4
SCHEMBL462819 0.88 NTRK1 (0.34) NR1H2RET
SCHEMBL12064985 0.88 DPP4 (0.33) NR1H2CKS1BSKP1SKP2GRM4
SCHEMBL470523 0.86 NTRK1 (0.35) NR1H2CKS1BSKP1SKP2EIF2AK4
SCHEMBL461775 0.85 OPRK1 (0.31) NR1H2MAP3K5RET
SCHEMBL12064745 0.84 NTRK1 (0.34) NR1H2RET
SCHEMBL12064744 0.84 NTRK1 (0.34) NR1H2RET

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-2011147951-A1 CYCLOAMINO DERIVATIVES AS GPR119 ANTAGONISTS PROSIDION LIMITED (GB) 2011-12-01 WO disclosed