SCHEMBL7307684

SCHEMBL7307684

CC(C)(C)OC(=O)NC(=N)N1CCC(CCCCN2CC(COS(C)(=O)=O)OC2=O)CC1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 15/20 0.39
MAPK1 P28482 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
FAAH O00519 1/20 0.31
RORC P51449 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
SCHEMBL7313885 0.97 GPR119 (0.38) GPR119MAPK1L3MBTL1FAAH
SCHEMBL7314189 0.94 GPR119 (0.33) GPR119FAAHRORC
SCHEMBL7313917 0.90 SIGMAR1 (0.34) MAPK1L3MBTL1
SCHEMBL7310460 0.88 SIGMAR1 (0.34) MAPK1L3MBTL1
SCHEMBL7313718 0.86 SIGMAR1 (0.31) MAPK1L3MBTL1
SCHEMBL7235475 0.83 USP30 (0.32) GPR119
SCHEMBL7306785 0.82 GPR119 (0.33) GPR119FAAH
SCHEMBL7307904 0.81 GPR119 (0.34) GPR119
SCHEMBL7306960 0.81 GPR119 (0.33) GPR119FAAH
SCHEMBL7310946 0.81 GPR119 (0.33) GPR119FAAH

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-0727425-A1 Adhesion receptor antagonists MERCK PATENT GmbH (DE) 1996-08-21 EP disclosed
EP-0711770-A1 Antagonists of adhesion receptors MERCK PATENT GmbH (DE) 1996-05-15 EP disclosed