SCHEMBL470680

SCHEMBL470680

C[C@H](Oc1cnc(Cl)nc1)C1CCN(c2nc(C(C)(F)F)no2)CC1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 9/20 0.39
GPR119 Q8TDV5 9/20 0.34
KCNH2 Q12809 3/20 0.34
GPR183 P32249 1/20 0.33
CNR2 P34972 2/20 0.32
EGFR P00533 1/20 0.31
KCNE1 P15382 1/20 0.31

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
SCHEMBL470686 0.93 GPR119 (0.40) ALOX5APGPR119KCNH2GPR183EGFR
SCHEMBL12064986 0.92 ALOX5AP (0.40) ALOX5APGPR119KCNH2GPR183CNR2
SCHEMBL12064808 0.81 ALOX5AP (0.35) ALOX5APGPR119KCNH2GPR183EGFR
SCHEMBL470597 0.76 GPR119 (0.45) ALOX5APGPR119
SCHEMBL470651 0.75 ALOX5AP (0.36) ALOX5APGPR119KCNH2GPR183EGFR
SCHEMBL462593 0.74 ALOX5AP (0.33) ALOX5APGPR119KCNH2EGFRKCNE1
SCHEMBL462592 0.74 ALOX5AP (0.33) ALOX5APGPR119KCNH2EGFRKCNE1
SCHEMBL462366 0.73 ALOX5AP (0.37) ALOX5APGPR119KCNH2GPR183CNR2
SCHEMBL6125564 0.73 GPR119 (0.41) ALOX5APGPR119
SCHEMBL19450516 0.72 GPR119 (0.40) ALOX5APGPR119KCNH2EGFRKCNE1

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-2011147951-A1 CYCLOAMINO DERIVATIVES AS GPR119 ANTAGONISTS PROSIDION LIMITED (GB) 2011-12-01 WO disclosed