SCHEMBL1773240

SCHEMBL1773240

CC(=O)OC(=O)N1CCC(CCCCC(=N)N)CC1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TPSAB1 Q15661 4/20 0.43
TPSD1 Q9BZJ3 4/20 0.43
TPSG1 Q9NRR2 4/20 0.43
F2 P00734 1/20 0.37
PRSS1 P07477 1/20 0.37
GNAI3 P08754 2/20 0.36
GNAO1 P09471 2/20 0.36
GNAI1 P63096 2/20 0.36
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
GAA P10253 1/20 0.36
GPR119 Q8TDV5 5/20 0.36
FAAH O00519 2/20 0.36
NOS3 P29474 1/20 0.35
NOS2 P35228 1/20 0.35

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
SCHEMBL1772704 0.96 TPSAB1 (0.43) TPSAB1TPSD1TPSG1F2PRSS1
SCHEMBL1773421 0.90 TPSAB1 (0.48) TPSAB1TPSD1TPSG1F2PRSS1
SCHEMBL12602276 0.84 GPR119 (0.51) GPR119FAAH
Acetic Acid SCHEMBL1773734 0.83 GPR119 (0.48) GPR119FAAH
Acetic Acid SCHEMBL1773238 0.82 F2 (0.44) TPSAB1TPSD1TPSG1F2PRSS1
SCHEMBL1773177 0.81 TPSAB1 (0.46) TPSAB1TPSD1TPSG1F2PRSS1
SCHEMBL12602269 0.80 FAAH (0.55) GPR119FAAH
Acetic Acid SCHEMBL1773776 0.79 FAAH (0.52) GPR119FAAH
Acetic Acid SCHEMBL1772702 0.77 ITGB3 (0.40) TPSAB1TPSD1TPSG1F2PRSS1
SCHEMBL1774295 0.77 TPSAB1 (0.45) TPSAB1TPSD1TPSG1F2PRSS1

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-20110112103-A1 5-HYDROXYPYRIMIDINE-4-CARBOXAMIDE COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-05-12 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-20110112103-A1 5-HYDROXYPYRIMIDINE-4-CARBOXAMIDE COMPOUND EPOR, CBR1, CBR3 TPSAB1 3078/4885TPSD1 1933/4885TPSG1 2986/4885

“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.