SCHEMBL8513541

SCHEMBL8513541

Cc1nc(-n2ccnn2)ccc1OCc1cnn(C2CCN(C(=O)O)CC2)c1C#N

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.48
USP14 P54578 1/20 0.33
PSEN1 P49768 2/20 0.32
PSEN2 P49810 2/20 0.32
APH1B Q8WW43 2/20 0.32
NCSTN Q92542 2/20 0.32
APH1A Q96BI3 2/20 0.32
PSENEN Q9NZ42 2/20 0.32
POLB P06746 2/20 0.31
KMT2A Q03164 2/20 0.31
LRRK2 Q5S007 1/20 0.30
HCRTR1 O43613 1/20 0.30
HCRTR2 O43614 1/20 0.30
ALPL P05186 1/20 0.30
ALPI P09923 1/20 0.30
ALPG P10696 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
SCHEMBL8511740 0.89 GPR119 (0.63) GPR119USP14PSEN1PSEN2APH1B
SCHEMBL2634612 0.87 GPR119 (0.49) GPR119PSEN1PSEN2APH1BNCSTN
SCHEMBL8513016 0.82 GPR119 (0.61) GPR119KMT2A
SCHEMBL2641575 0.82 GPR119 (0.52) GPR119PSEN1PSEN2APH1BNCSTN
SCHEMBL1060222 0.78 GPR119 (0.49) GPR119
SCHEMBL8515298 0.75 GPR119 (0.58) GPR119
SCHEMBL2634756 0.74 GPR119 (0.64) GPR119KMT2A
SCHEMBL8511959 0.74 GPR119 (0.76) GPR119
SCHEMBL9883058 0.73 GPR119 (0.65) GPR119
SCHEMBL2634581 0.73 GPR119 (0.58) GPR119KMT2A

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