SCHEMBL4263363

SCHEMBL4263363

CN(CC1CCN(C(=O)OC(C)(C)C)CC1)c1cc(Cl)ncn1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 15/20 0.51
TBK1 Q9UHD2 1/20 0.45
FAAH O00519 1/20 0.43
KDM4E B2RXH2 1/20 0.42
PKM P14618 1/20 0.42
LIMK2 P53671 1/20 0.42

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
SCHEMBL5889155 0.87 GPR119 (0.53) GPR119TBK1FAAH
SCHEMBL389866 0.82 GPR119 (0.46) GPR119TBK1KDM4EPKMLIMK2
SCHEMBL5399943 0.82 GPR119 (0.45) GPR119FAAHKDM4EPKMLIMK2
SCHEMBL5399734 0.80 FAAH (0.47) GPR119TBK1FAAHKDM4EPKM
SCHEMBL390655 0.79 TBK1 (0.46) GPR119TBK1KDM4ELIMK2
SCHEMBL391299 0.79 GPR119 (0.46) GPR119TBK1KDM4EPKMLIMK2
SCHEMBL390308 0.79 TBK1 (0.46) GPR119TBK1LIMK2
SCHEMBL27747830 0.79 GPR119 (0.49) GPR119TBK1LIMK2
SCHEMBL391077 0.79 TBK1 (0.47) GPR119TBK1KDM4EPKMLIMK2
SCHEMBL388956 0.79 GPR119 (0.46) GPR119TBK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101870690-A The prevention and the treatment that are substituted aryl and heteroaryl derivative and associated conditions thereof as metabolism regulators ARENA PHARM INC 2010-10-27 CN disclosed
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
EP-1756084-B1 SUBSTITUTED ARYL AND HETEROARYL DERIVATIVES AS MODULATORS OF METABOLISM AND THE PROPHYLAXIS AND TREATMENT OF DISORDERS RELATED THERETO ARENA PHARM INC (US) 2008-11-26 EP disclosed
CN-1997640-A Substituted aryl and heteroaryl derivatives as modulators of metabolism and the prevention and treatment of disorders related thereto ARENA PHARM INC (US) 2007-07-11 CN disclosed
EP-1756084-A2 SUBSTITUTED ARYL AND HETEROARYL DERIVATIVES AS MODULATORS OF METABOLISM AND THE PROPHYLAXIS AND TREATMENT OF DISORDERS RELATED THERETO Arena Pharmaceuticals, Inc. (US) 2007-02-28 EP disclosed
WO-2005121121-A2 SUBSTITUTED ARYL AND HETEROARYL DERIVATIVES AS MODULATORS OF METABOLISM AND THE PROPHYLAXIS AND TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2005-12-22 WO 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 31/4885TBK1 4689/4885FAAH 852/4885

“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.