SCHEMBL8713112

SCHEMBL8713112

CC(C)(C)OC(=O)N1CCC(CCN2Cc3cccc4ncc(n34)C2)CC1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 13/20 0.45
KDM4E B2RXH2 1/20 0.44
PKM P14618 1/20 0.44
FAAH O00519 1/20 0.43
TGFBR1 P36897 2/20 0.41

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
SCHEMBL7863430 0.84 GPR119 (0.46) GPR119KDM4EPKMFAAH
SCHEMBL7863491 0.81 GPR119 (0.45) GPR119KDM4EPKMFAAH
SCHEMBL7863458 0.79 FPR2 (0.43) GPR119KDM4EPKMFAAH
SCHEMBL7871693 0.77 GPR119 (0.43) GPR119KDM4EPKMFAAH
SCHEMBL7863517 0.74 GPR119 (0.46) GPR119KDM4EPKMFAAH
SCHEMBL7868718 0.72 PIK3CA (0.46) GPR119KDM4EPKMFAAH
SCHEMBL7863410 0.72 PIK3CA (0.46) GPR119KDM4EPKMFAAH
SCHEMBL7983977 0.72 KDM4E (0.50) KDM4EPKMTGFBR1
SCHEMBL948301 0.71 GPR119 (0.48) GPR119KDM4E
SCHEMBL4518724 0.71 GPR119 (0.53) GPR119

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-0826686-A2 Tricyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-03-04 EP disclosed