SCHEMBL4266588

SCHEMBL4266588

CC(C)(C)OC(=O)N1CCC(Oc2cc(Nc3ccc(S(C)(=O)=O)cc3F)ccn2)CC1

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 19/20 0.60
CYP3A4 P08684 1/20 0.57
CYP2C9 P11712 1/20 0.57

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
SCHEMBL389810 0.88 GPR119 (0.77) GPR119CYP2C9
SCHEMBL386244 0.87 GPR119 (0.79) GPR119CYP3A4CYP2C9
SCHEMBL3343620 0.85 GPR119 (0.65) GPR119CYP3A4CYP2C9
SCHEMBL386360 0.83 GPR119 (0.62) GPR119CYP3A4CYP2C9
SCHEMBL389528 0.83 GPR119 (0.59) GPR119CYP3A4CYP2C9
SCHEMBL3343623 0.81 GPR119 (0.59) GPR119CYP3A4CYP2C9
SCHEMBL4722426 0.80 GPR119 (0.60) GPR119CYP2C9
SCHEMBL3343342 0.80 GPR119 (0.59) GPR119CYP3A4CYP2C9
SCHEMBL3343283 0.80 GPR119 (0.63) GPR119CYP3A4CYP2C9
SCHEMBL5048402 0.80 GPR119 (0.49) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090036434-A1 Substituted aryl and heteroaryl derivatives as modulators of metabolism and the prophylaxis and treatment of disorders related thereto ARENA PHARMACEUTICALS, INC. (US) 2009-02-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090036434-A1 Substituted aryl and heteroaryl derivatives as modulators of metabolism and the prophylaxis and treatment of disorders related thereto CYP7A1, CYP27A1, CYP11B1 GPR119 31/4885CYP3A4 29/4885CYP2C9 54/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.