SCHEMBL3434677

SCHEMBL3434677

CC(C)(C)OC(=O)NC(CC(=O)C1CC(=O)N(CC(=O)NC2CC2)c2ccccc2N1)Cc1cc(F)c(F)cc1F

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 18/20 0.39
DPP4 P27487 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
SCHEMBL3432056 0.81 DPP4 (0.45) SCN9ADPP4
SCHEMBL3428531 0.70 DPP4 (0.45) SCN9ADPP4
SCHEMBL3426850 0.70 DPP4 (0.47) SCN9ADPP4
SCHEMBL3434679 0.69 SCN9A (0.34) SCN9ADPP4
SCHEMBL2358045 0.69 DPP4 (0.38) SCN9ADPP4
SCHEMBL3427590 0.68 DPP4 (0.50) SCN9ADPP4
SCHEMBL3764856 0.67 DPP4 (0.48) SCN9ADPP4
SCHEMBL342707 0.67 DPP4 (0.43) DPP4
SCHEMBL342708 0.67 DPP4 (0.43) DPP4
SCHEMBL19500634 0.67 DPP4 (0.43) DPP4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2250157-A1 NOVEL HETEROCYCLIC COMPOUNDS Panacea Biotec Limited (IN) 2010-11-17 EP disclosed
WO-2009093269-A1 NOVEL HETEROCYCLIC COMPOUNDS PANACEA BIOTEC LIMITED (IN) 2009-07-30 WO disclosed