SCHEMBL27313243

SCHEMBL27313243

CC(C)(C)OC(=O)N1CCC(C#Cc2ccncn2)CC1

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 16/20 0.59
GRM5 P41594 1/20 0.46

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
SCHEMBL30824737 0.82 GPR119 (0.47) GPR119
SCHEMBL24233245 0.80 GPR119 (0.50) GPR119GRM5
SCHEMBL27391936 0.80 ALDH1A1 (0.52) GPR119
SCHEMBL16973168 0.80 ALDH1A1 (0.51) GPR119
SCHEMBL1199881 0.80 GPR119 (0.58) GPR119GRM5
SCHEMBL27007401 0.78 GPR119 (0.48) GPR119
SCHEMBL30851996 0.78 GPR119 (0.47) GPR119
SCHEMBL25888858 0.77 GPR119 (0.65) GPR119
SCHEMBL30490329 0.76 GPR119 (0.45) GPR119
SCHEMBL30812264 0.76 GPR119 (0.55) GPR119

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
WO-2024059096-A2 C5AR1 ANTAGONISTS AND USES THEREOF VANQUA BIO, INC. (US) 2024-03-21 WO disclosed