SCHEMBL7602450

SCHEMBL7602450

COC(=O)C1C[C@H](n2ncc(COc3ccc(-n4cnnn4)nc3)n2)CCN1C(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 15/20 0.41
KCNJ1 P48048 1/20 0.35
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ALOX15 P16050 1/20 0.33
KMT2A Q03164 1/20 0.33
HRH2 P25021 1/20 0.33
HRH1 P35367 1/20 0.33
RET P07949 1/20 0.32
HDAC1 Q13547 1/20 0.31

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
SCHEMBL4279093 1.00 GPR119 (0.41) GPR119KCNJ1MEN1ALDH1A1ALOX15
SCHEMBL16258810 1.00 GPR119 (0.41) GPR119KCNJ1MEN1ALDH1A1ALOX15
SCHEMBL7588343 1.00 GPR119 (0.41) GPR119KCNJ1MEN1ALDH1A1ALOX15
SCHEMBL4279095 1.00 GPR119 (0.41) GPR119KCNJ1MEN1ALDH1A1ALOX15
SCHEMBL3689286 0.90 KCNJ1 (0.37) GPR119KCNJ1MEN1ALDH1A1ALOX15
SCHEMBL14315928 0.90 GPR119 (0.36) GPR119KCNJ1MEN1ALDH1A1ALOX15
SCHEMBL4286308 0.83 GPR119 (0.44) GPR119KCNJ1MEN1ALDH1A1ALOX15
SCHEMBL7586924 0.82 GPR119 (0.43) GPR119KCNJ1MEN1ALDH1A1ALOX15
SCHEMBL7593060 0.81 GPR119 (0.49) GPR119KCNJ1
SCHEMBL3694315 0.81 GPR119 (0.48) GPR119KCNJ1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8183381-B2 N-linked heterocyclic receptor agonists for the treatment of diabetes and metabolic disorders METABOLEX INC. (US) 2012-05-22 US disclosed
US-20090137590-A1 N-LINKED HETEROCYCLIC RECEPTOR AGONISTS FOR THE TREATMENT OF DIABETES AND METABOLIC DISORDERS METABOLEX INC. 2009-05-28 US disclosed
WO-2009014910-A2 N-AZACYCLIC SUBSTITUTED PYRROLE, PYRAZOLE, IMIDAZOLE, TRIAZOLE AND TETRAZOLE DERIVATIVES AS AGONISTS OF THE RUP3 OR GPR119 RECEPTOR FOR THE TREATMENT OF DIABETES AND METABOLIC DISORDERS METABOLEX, INC. (US) 2009-01-29 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-20090137590-A1 N-LINKED HETEROCYCLIC RECEPTOR AGONISTS FOR THE TREATMENT OF DIABETES AND METABOLIC DISORDERS GPR119, INSR, GLP1R GPR119 1/4885KCNJ1 2412/4885MEN1 3843/4885

“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.