SCHEMBL1002647

SCHEMBL1002647

C[C@H]1C[C@@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.39
GPR119 Q8TDV5 5/20 0.35
NR1H2 P55055 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
TSHR P16473 1/20 0.34
USP2 O75604 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAP4K4 O95819 1/20 0.32
HSD11B1 P28845 1/20 0.32
UCHL1 P09936 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL4881677 1.00 PIK3CD (0.39) PIK3CDGPR119NR1H2CHRM2CHRM1
SCHEMBL18720126 1.00 PIK3CD (0.39) PIK3CDGPR119NR1H2CHRM2CHRM1
SCHEMBL18544370 1.00 PIK3CD (0.39) PIK3CDGPR119NR1H2CHRM2CHRM1
SCHEMBL1003494 1.00 PIK3CD (0.39) PIK3CDGPR119NR1H2CHRM2CHRM1
SCHEMBL4079476 1.00 PIK3CD (0.39) PIK3CDGPR119NR1H2CHRM2CHRM1
SCHEMBL21077204 0.86 CHRM2 (0.38) GPR119NR1H2CHRM2CHRM1CHRM3
SCHEMBL4336342 0.84 PPM1D (0.34) TSHR
SCHEMBL3954202 0.84 PPM1D (0.34) TSHR
SCHEMBL2809688 0.83 UCHL1 (0.39) NR1H2CHRM2CHRM1CHRM3USP2
SCHEMBL4300617 0.83 UCHL1 (0.37) NR1H2CHRM2CHRM1CHRM3TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7875633-B2 4-[(4-Chlorobenzyl)oxy]-1-(4-[(1E)-3-(methylamino)-1-propen-1-yl]phenyl)pyridin-2(1H)-one; remedy for metabolic disorders such as obesity, diabetes, hormone disorder; cardiovascular disorders (stenocardia, acute or congestive heart failure); nervous system disorders (bulimia, anxiety, epilepsy etc.) BANYU PHARMACEUTICAL CO., LTD. (JP) 2011-01-25 US disclosed
EP-1921065-B1 PHENYLPYRIDONE DERIVATIVE BANYU PHARMA CO LTD (JP) 2010-10-20 EP disclosed
US-20090137587-A1 Phenylpyridone Derivative MSD K.K. (JP) 2009-05-28 US disclosed
EP-1921065-A1 PHENYLPYRIDONE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2008-05-14 EP 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-20090137587-A1 Phenylpyridone Derivative NAT1, NPR1, PC PIK3CD 4287/4885GPR119 31/4885NR1H2 408/4885

“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.