SCHEMBL6109871

SCHEMBL6109871

CC(C)Cn1c(CN(C(=O)O)C(C)(C)C)c(-c2ccccc2)c2cc(O)ccc2c1=O

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 20/20 0.68

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
SCHEMBL6107373 0.96 DPP4 (0.62) DPP4
SCHEMBL6108455 0.92 DPP4 (0.57) DPP4
SCHEMBL6107712 0.92 DPP4 (0.56) DPP4
SCHEMBL6107884 0.92 DPP4 (0.56) DPP4
SCHEMBL6109442 0.91 DPP4 (0.56) DPP4
SCHEMBL6108219 0.89 DPP4 (0.55) DPP4
SCHEMBL6109634 0.89 DPP4 (0.67) DPP4
SCHEMBL6107720 0.89 DPP4 (0.61) DPP4
SCHEMBL6107475 0.89 DPP4 (0.53) DPP4
SCHEMBL6108426 0.89 DPP4 (0.62) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7034039-B2 Fused heterocyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-04-25 US disclosed