SCHEMBL14730240

SCHEMBL14730240

CNC1CCN(c2nc(C(C)(C)F)no2)CC1

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.42
ALOX5AP P20292 6/20 0.36
HRH4 Q9H3N8 10/20 0.35
HRH3 Q9Y5N1 2/20 0.35

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
Hydrochloric Acid SCHEMBL14723462 0.99 GPR119 (0.41) GPR119ALOX5APHRH4HRH3
SCHEMBL6125573 0.91 GPR119 (0.38) GPR119ALOX5APHRH4HRH3
Hydrochloric Acid SCHEMBL6125721 0.90 GPR119 (0.37) GPR119ALOX5APHRH4HRH3
SCHEMBL14730241 0.90 GPR119 (0.38) GPR119ALOX5APHRH4HRH3
SCHEMBL14730237 0.88 HRH4 (0.39) GPR119ALOX5APHRH4HRH3
SCHEMBL8578929 0.82 GPR119 (0.43) GPR119ALOX5APHRH4HRH3
SCHEMBL8614390 0.80 GPR119 (0.38) GPR119ALOX5AP
Hydrochloric Acid SCHEMBL14723461 0.77 GPR119 (0.42) GPR119ALOX5AP
SCHEMBL14730201 0.77 GPR119 (0.41) GPR119ALOX5AP
SCHEMBL14730311 0.77 GPR119 (0.36) GPR119ALOX5AP

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-2013026587-A1 1,4 DISUBSTITUTED PYRROLIDINE - 3 - YL -AMINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2013-02-28 WO disclosed