SCHEMBL8514711

SCHEMBL8514711

Cc1ncccc1OCc1cnn([C@@H]2CCN(C(=O)O)C[C@@H]2F)c1C#N

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.43
SSTR4 P31391 1/20 0.36
CHRNB2 P17787 2/20 0.35
CHRNA4 P43681 2/20 0.35
CHRNB1 P11230 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNB3 Q05901 1/20 0.35
HCRTR2 O43614 2/20 0.34
HCRTR1 O43613 1/20 0.34
PSEN1 P49768 2/20 0.33
PSEN2 P49810 2/20 0.33
APH1B Q8WW43 2/20 0.33
NCSTN Q92542 2/20 0.33
APH1A Q96BI3 2/20 0.33
PSENEN Q9NZ42 2/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
GCK P35557 1/20 0.33

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
SCHEMBL8612817 1.00 GPR119 (0.43) GPR119SSTR4CHRNB2CHRNA4CHRNB1
SCHEMBL8514825 1.00 GPR119 (0.43) GPR119SSTR4CHRNB2CHRNA4CHRNB1
SCHEMBL9883040 0.90 GPR119 (0.44) GPR119SSTR4GCK
SCHEMBL9883079 0.90 GPR119 (0.44) GPR119SSTR4GCK
SCHEMBL8511937 0.88 GPR119 (0.57) GPR119SSTR4
SCHEMBL8511594 0.88 GPR119 (0.57) GPR119SSTR4
SCHEMBL2641575 0.86 GPR119 (0.52) GPR119SSTR4CHRNB2CHRNA4CHRNB1
SCHEMBL8515570 0.82 GPR119 (0.38) GPR119HCRTR2
SCHEMBL8515406 0.80 GPR119 (0.51) GPR119
SCHEMBL8514043 0.80 GPR119 (0.51) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2643310-A1 4- (5-CYANO-PYRAZOL-1-YL) -PIPERIDINE DERIVATIVES AS GPR 119 MODULATORS Pfizer Inc (US) 2013-10-02 EP claimed
WO-2012069948-A1 4- (5-CYANO-PYRAZOL-1-YL) -PIPERIDINE DERIVATIVES AS GPR 119 MODULATORS PFIZER INC. (US) 2012-05-31 WO claimed
EP-2643310-A1 4- (5-CYANO-PYRAZOL-1-YL) -PIPERIDINE DERIVATIVES AS GPR 119 MODULATORS Pfizer Inc (US) 2013-10-02 EP disclosed
WO-2012069948-A1 4- (5-CYANO-PYRAZOL-1-YL) -PIPERIDINE DERIVATIVES AS GPR 119 MODULATORS PFIZER INC. (US) 2012-05-31 WO disclosed