SCHEMBL2729587

SCHEMBL2729587

Cc1c(Oc2ccc(CC3COS(=O)OC3)nc2)ncnc1OC1CCN(C(=O)O)CC1

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 16/20 0.43
PIK3CD O00329 4/20 0.38
CYP2C9 P11712 1/20 0.37

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
SCHEMBL2716463 0.90 GPR119 (0.54) GPR119PIK3CD
SCHEMBL2716461 0.90 GPR119 (0.54) GPR119PIK3CD
SCHEMBL2718743 0.90 GPR119 (0.54) GPR119PIK3CD
SCHEMBL2716251 0.89 GPR119 (0.47) GPR119PIK3CDCYP2C9
SCHEMBL15233983 0.88 GPR119 (0.36) GPR119PIK3CD
SCHEMBL15234222 0.88 GPR119 (0.36) GPR119PIK3CD
SCHEMBL15233981 0.88 GPR119 (0.36) GPR119PIK3CD
SCHEMBL15234224 0.88 GPR119 (0.36) GPR119PIK3CD
SCHEMBL2717830 0.83 GPR119 (0.47) GPR119CYP2C9
SCHEMBL15234153 0.81 GPR119 (0.57) GPR119PIK3CDCYP2C9

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-2445904-A1 NOVEL GPR 119 AGONISTS Cadila Healthcare Limited (IN) 2012-05-02 EP claimed
WO-2010146605-A1 NOVEL GPR 119 AGONISTS CADILA HEALTHCARE LIMITED (IN) 2010-12-23 WO claimed
EP-2445904-A1 NOVEL GPR 119 AGONISTS Cadila Healthcare Limited (IN) 2012-05-02 EP disclosed
WO-2010146605-A1 NOVEL GPR 119 AGONISTS CADILA HEALTHCARE LIMITED (IN) 2010-12-23 WO disclosed