SCHEMBL470608

SCHEMBL470608

CCn1nnc(N2CCC([C@H](C)Oc3cnc(N4C[C@H](NC(=O)OC(C)(C)C)[C@@H](c5cc(F)ccc5F)C4)nc3)CC2)n1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 5/20 0.37
RET P07949 8/20 0.35
NR1H2 P55055 1/20 0.34
CKS1B P61024 1/20 0.33
SKP1 P63208 1/20 0.33
SKP2 Q13309 1/20 0.33
GPR119 Q8TDV5 1/20 0.33
MAP3K5 Q99683 1/20 0.33
NPY5R Q15761 3/20 0.32

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
SCHEMBL470699 0.87 DPP4 (0.35)
SCHEMBL470564 0.87 NTRK1 (0.36) NTRK1RETNR1H2GPR119NPY5R
SCHEMBL14730243 0.86 GPR119 (0.36) NTRK1GPR119
SCHEMBL470590 0.85 NTRK1 (0.38) NTRK1RETGPR119
SCHEMBL14730211 0.85 NTRK1 (0.36) NTRK1RETNR1H2CKS1BSKP1
SCHEMBL460032 0.85 NTRK1 (0.38) NTRK1RET
SCHEMBL470647 0.85 CKS1B (0.32) RETCKS1BSKP1SKP2GPR119
SCHEMBL470601 0.85 NTRK1 (0.38) NTRK1RETNR1H2NPY5R
SCHEMBL12064739 0.84 NTRK1 (0.35) NTRK1RETNR1H2CKS1BSKP1
SCHEMBL470523 0.84 NTRK1 (0.35) NTRK1RETNR1H2CKS1BSKP1

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