SCHEMBL3705463

SCHEMBL3705463

CC(C)C1CC(N2CCOc3c(Cl)ncnc32)CCN1C(=O)O

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SMYD3 Q9H7B4 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
SCHEMBL1449814 0.80 DGAT1 (0.34)
SCHEMBL1450232 0.78 HTR2A (0.33)
SCHEMBL1449700 0.76 PIK3R1 (0.41)
SCHEMBL1449637 0.73 HTR2A (0.38)
SCHEMBL3692573 0.72 VNN1 (0.33)
SCHEMBL1450149 0.71 GPR119 (0.44)
SCHEMBL11901108 0.70 GPR119 (0.39)
SCHEMBL4572398 0.70 PIK3R1 (0.38)
SCHEMBL20568753 0.69 NOTUM (0.38)
SCHEMBL1449824 0.63 RET (0.34)

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-2144902-B1 [6,6]AND [6,7]-BICYCLIC GPR119 G PROTEIN-COUPLED RECEPTOR AGONISTS BRISTOL MYERS SQUIBB CO (US) 2012-05-16 EP disclosed