SCHEMBL1902446

SCHEMBL1902446

CC(C)c1noc(C2CCN(c3cc(Oc4ccc(-c5csnn5)cc4)nc(C4COCO4)n3)CC2)n1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 4/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ CNR2 P34972 1/20 0.36
▸ SCN9A Q15858 1/20 0.31
▸ GPR183 P32249 1/20 0.31
▸ EPHX2 P34913 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
SCHEMBL27652127 0.74 GPR119 (0.46) GPR119CYP3A4CYP2C19CNR2SCN9A
SCHEMBL27755050 0.74 GPR119 (0.43) GPR119CYP3A4CYP2C19CNR2SCN9A
SCHEMBL387943 0.74 GPR119 (0.47) GPR119CYP3A4CYP2C19CNR2SCN9A
SCHEMBL387913 0.72 GPR119 (0.48) GPR119CYP3A4CYP2C19CNR2SCN9A
SCHEMBL389242 0.72 GPR119 (0.47) GPR119CYP3A4CYP2C19CNR2SCN9A
SCHEMBL389113 0.72 GPR119 (0.46) GPR119CYP3A4CYP2C19CNR2SCN9A
SCHEMBL388922 0.71 GPR119 (0.46) GPR119CYP3A4CYP2C19CNR2SCN9A
SCHEMBL390445 0.65 GPR119 (0.58) GPR119CYP3A4CYP2C19CNR2GPR183
SCHEMBL3740574 0.63 GPR119 (0.43) GPR119CYP3A4CYP2C19CNR2SCN9A
SCHEMBL19454675 0.61 CNR2 (0.44) GPR119CYP3A4CYP2C19CNR2SCN9A

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-2322150-A2 Method of identifying GLP-1 secretagogues Arena Pharmaceuticals, Inc. (US) 2011-05-18 — — EP disclosed
Send feedback