SCHEMBL12835637

SCHEMBL12835637

C=C(/N=C(\ON)N1CCC(Oc2ccnc3c(-c4ccc(S(=O)(=O)NC(=O)CC)cc4F)c(C)nn23)CC1)C(C)C

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.32
CYP2C9 P11712 3/20 0.32
KCNH2 Q12809 1/20 0.32
HRH1 P35367 1/20 0.31
CCR3 P51677 1/20 0.31
RECQL P46063 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
SCHEMBL389558 0.85 GPR119 (0.46) GPR119CYP2C9KCNH2
SCHEMBL12914862 0.82 SCN9A (0.35) GPR119HRH1CCR3RECQL
SCHEMBL388687 0.79 GPR119 (0.49) GPR119KCNH2
SCHEMBL390806 0.78 GPR119 (0.37) GPR119KCNH2
SCHEMBL1071774 0.75 GPR119 (0.48) GPR119CYP2C9KCNH2
SCHEMBL390808 0.74 GPR119 (0.56) GPR119CYP2C9KCNH2
SCHEMBL391549 0.73 GPR119 (0.47) GPR119CYP2C9KCNH2
SCHEMBL12835902 0.70 GPR119 (0.42) GPR119CYP2C9KCNH2
SCHEMBL12914861 0.69 SCN9A (0.36) GPR119
SCHEMBL390529 0.68 GPR119 (0.44) GPR119CYP2C9KCNH2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2292620-A2 Fused-aryl and heteroaryl derivatives as modulators of metabolism and the prohylaxis and treatment of disorders related thereto Arena Pharmaceuticals, Inc. (US) 2011-03-09 EP disclosed
EP-2287165-A2 Fused-aryl and heteroaryl derivatives as modulators of metabolism and the prophylaxis and treatment of disorders related thereto Arena Pharmaceuticals, Inc. (US) 2011-02-23 EP disclosed