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SCHEMBL7307310

SCHEMBL7307310

COC(=O)CCCN1CCN(CC2CN(CCCCC3CCN(C(=N)NC(=O)OC(C)(C)C)CC3)C(=O)O2)CC1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 1/20 0.32
▸ DRD2 P14416 6/20 0.31
▸ DRD3 P35462 3/20 0.31
▸ HTR4 Q13639 2/20 0.31
▸ FAAH O00519 1/20 0.31
▸ SIGMAR1 Q99720 1/20 0.30
▸ NAAA Q02083 2/20 0.30
▸ CHRM2 P08172 1/20 0.30
▸ CHRM1 P11229 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
SCHEMBL7316594 0.98 DRD2 (0.33) GPR119DRD2DRD3HTR4FAAH
SCHEMBL7318097 0.96 GPR119 (0.33) GPR119DRD2DRD3FAAHNAAA
SCHEMBL7316078 0.95 DRD2 (0.33) GPR119DRD2DRD3HTR4FAAH
SCHEMBL7307759 0.94 FAAH (0.33) GPR119DRD2DRD3FAAHCHRM2
SCHEMBL7309796 0.94 SIGMAR1 (0.34) DRD2SIGMAR1CHRM2CHRM1
SCHEMBL7310946 0.93 GPR119 (0.33) GPR119DRD2DRD3FAAHSIGMAR1
SCHEMBL7307904 0.92 GPR119 (0.34) GPR119
SCHEMBL7314509 0.92 SIGMAR1 (0.34) DRD2SIGMAR1CHRM2CHRM1
SCHEMBL7306960 0.91 GPR119 (0.33) GPR119DRD2DRD3FAAHSIGMAR1
SCHEMBL7313311 0.91 FAAH (0.33) GPR119DRD2DRD3FAAHSIGMAR1

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