SCHEMBL7606064

SCHEMBL7606064

CC1CN(C(=O)O)CCC1n1ncc(COc2ccc(-n3cnnn3)nc2)n1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNJ1 P48048 11/20 0.40
GPR119 Q8TDV5 6/20 0.40
ALDH1A1 P00352 2/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
ALOX15 P16050 1/20 0.35
HPGD P15428 1/20 0.35
KCNH2 Q12809 4/20 0.34
POLB P06746 1/20 0.32

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
SCHEMBL3694659 1.00 KCNJ1 (0.40) KCNJ1GPR119ALDH1A1KMT2AMEN1
SCHEMBL7593060 0.90 GPR119 (0.49) KCNJ1GPR119
SCHEMBL3687098 0.83 GPR119 (0.42) KCNJ1GPR119ALDH1A1KMT2AMEN1
SCHEMBL7592847 0.83 GPR119 (0.42) KCNJ1GPR119ALDH1A1KMT2AMEN1
SCHEMBL7587789 0.83 GPR119 (0.40) KCNJ1GPR119ALDH1A1KMT2AMEN1
SCHEMBL3690019 0.83 KCNJ1 (0.37) KCNJ1GPR119ALDH1A1KMT2AMEN1
SCHEMBL3691202 0.83 GPR119 (0.40) KCNJ1GPR119ALDH1A1KMT2AMEN1
SCHEMBL7589821 0.82 GPR119 (0.49) KCNJ1GPR119KCNH2
SCHEMBL3685203 0.82 GPR119 (0.49) KCNJ1GPR119KCNH2
SCHEMBL13955302 0.81 KCNJ1 (0.41) KCNJ1GPR119ALDH1A1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2185544-B1 N-AZACYCLIC SUBSTITUTED PYRROLE, PYRAZOLE, IMIDAZOLE, TRIAZOLE AND TETRAZOLE DERIVATIVES AS AGONISTS OF THE RUP3 OR GPR119 FOR THE TREATMENT OF DIABETES AND METABOLIC DISORDERS CYMABAY THERAPEUTICS INC (US) 2014-11-26 EP claimed
US-20120322804-A1 N-LINKED HETEROCYCLIC RECEPTOR AGONISTS FOR THE TREATMENT OF DIABETES AND METABOLIC DISORDERS METABOLEX INC. 2012-12-20 US disclosed
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 (2 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 KCNJ1 2412/4885GPR119 1/4885ALDH1A1 2066/4885
US-20120322804-A1 N-LINKED HETEROCYCLIC RECEPTOR AGONISTS FOR THE TREATMENT OF DIABETES AND METABOLIC DISORDERS GPR119, INSR, GLP1R KCNJ1 2412/4885GPR119 1/4885ALDH1A1 2066/4885

“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.