SCHEMBL7313311

SCHEMBL7313311

CC(C)(C)OC(=O)NC(=N)N1CCC(CCCN2CC(CN3CCN(CCCC(=O)O)CC3)OC2=O)CC1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.33
SIGMAR1 Q99720 3/20 0.33
CHRM2 P08172 1/20 0.32
CHRM1 P11229 1/20 0.32
DRD2 P14416 4/20 0.32
DRD3 P35462 4/20 0.32
GPR119 Q8TDV5 6/20 0.32
NPY1R P25929 1/20 0.31
S1PR5 Q9H228 1/20 0.31
ITGB3 P05106 2/20 0.30
ITGA2B P08514 2/20 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
SCHEMBL7310946 0.98 GPR119 (0.33) FAAHSIGMAR1CHRM2CHRM1DRD2
SCHEMBL7310892 0.96 DRD2 (0.33) FAAHSIGMAR1CHRM2CHRM1DRD2
SCHEMBL7316507 0.96 FAAH (0.33) FAAHSIGMAR1CHRM2CHRM1DRD2
SCHEMBL7306960 0.94 GPR119 (0.33) FAAHSIGMAR1DRD2DRD3GPR119
SCHEMBL7316594 0.93 DRD2 (0.33) FAAHSIGMAR1CHRM2CHRM1DRD2
SCHEMBL7314220 0.93 SIGMAR1 (0.36) SIGMAR1CHRM2CHRM1DRD2
SCHEMBL7309308 0.93 SIGMAR1 (0.36) SIGMAR1CHRM2CHRM1DRD2
SCHEMBL7306190 0.92 GPR119 (0.32) FAAHDRD2DRD3GPR119
SCHEMBL7316461 0.91 DRD2 (0.34) FAAHSIGMAR1DRD2DRD3
SCHEMBL7307508 0.91 SIGMAR1 (0.36) SIGMAR1CHRM2CHRM1DRD2

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-0711770-A1 Antagonists of adhesion receptors MERCK PATENT GmbH (DE) 1996-05-15 EP disclosed