SCHEMBL8470397

SCHEMBL8470397

CC(C)(C)OC(=O)N1CC[C@H](Oc2ccc(OC(=O)CCCc3cc4cc(C#N)ccc4s3)cc2)C1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.50
ALK Q9UM73 1/20 0.40
USP30 Q70CQ3 1/20 0.39
CETP P11597 1/20 0.39
CHEK2 O96017 1/20 0.37
TNKS O95271 1/20 0.36
PARP1 P09874 1/20 0.36
TNKS2 Q9H2K2 1/20 0.36
EPHX2 P34913 1/20 0.36

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
SCHEMBL8469683 0.91 GPR119 (0.57) GPR119ALKCETPCHEK2
SCHEMBL8469556 0.89 GPR119 (0.51) GPR119ALKUSP30CETPCHEK2
SCHEMBL7390604 0.84 GPR119 (0.46) GPR119ALKCETP
SCHEMBL8469743 0.82 GPR119 (0.54) GPR119ALKUSP30CETPCHEK2
SCHEMBL8471547 0.82 GPR119 (0.54) GPR119ALKUSP30CETPCHEK2
SCHEMBL8472255 0.81 GPR119 (0.39) GPR119ALKCETP
SCHEMBL8470087 0.81 GPR119 (0.52) GPR119ALKUSP30CETPCHEK2
SCHEMBL7387156 0.80 GPR119 (0.48) GPR119ALKUSP30CETPCHEK2
SCHEMBL7391018 0.78 GPR119 (0.40) GPR119CETP
SCHEMBL24117836 0.77 GPR119 (0.79) GPR119ALKUSP30

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
US-5962695-A ANTICOAGULANT DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1999-10-05 US disclosed
US-5866577-A AN ANTICOAGULANT AGENT DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1999-02-02 US disclosed