SCHEMBL1445594

SCHEMBL1445594

CC(C)OC(=O)N1CCCCC1Oc1cc(Cl)ncn1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 18/20 0.40
PREP P48147 1/20 0.35
FAP Q12884 1/20 0.35
S1PR1 P21453 1/20 0.34
CYP2C9 P11712 1/20 0.34

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
SCHEMBL288623 0.83 S1PR1 (0.36) PREPFAPS1PR1CYP2C9
SCHEMBL288373 0.80 GPR119 (0.58) GPR119CYP2C9
SCHEMBL290305 0.80 GPR119 (0.45) GPR119CYP2C9
SCHEMBL5201630 0.77 GPR119 (0.53) GPR119CYP2C9
SCHEMBL6066337 0.74 GPR119 (0.58) GPR119CYP2C9
SCHEMBL17559337 0.69 GPR119 (0.49) GPR119S1PR1
SCHEMBL16503907 0.68 GPR119 (0.58) GPR119CYP2C9
SCHEMBL29986931 0.68 ALDH1A1 (0.38) GPR119
SCHEMBL557714 0.67 S1PR1 (0.50) S1PR1
SCHEMBL1066568 0.66 GPR119 (0.57) 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-2504342-A1 IMIDAZO-PYRAZOLES AS GPR119 INHIBITORS Pfizer Inc. (US) 2012-10-03 EP disclosed
EP-2480551-A1 GPR 119 MODULATORS Pfizer Inc. (US) 2012-08-01 EP disclosed
WO-2011061679-A1 IMIDAZO-PYRAZOLES AS GPR119 INHIBITORS PFIZER INC. (US) 2011-05-26 WO disclosed
WO-2011036576-A1 GPR 119 MODULATORS PFIZER INC. (US) 2011-03-31 WO disclosed