SCHEMBL12359658

SCHEMBL12359658

CC(C)(C)OC(=O)N1CCc2cc(F)c(N)cc21

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 9/20 0.48
NR1H2 P55055 1/20 0.44
CHRM4 P08173 1/20 0.42
DRD2 P14416 1/20 0.42
HTR7 P34969 1/20 0.42
DHODH Q02127 1/20 0.42
ESR2 Q92731 1/20 0.40
MPO P05164 1/20 0.39
NOTUM Q6P988 2/20 0.39
KDM1A O60341 1/20 0.39
ABHD6 Q9BV23 1/20 0.38
DPP4 P27487 1/20 0.37
SCN5A Q14524 1/20 0.36
SCN9A Q15858 1/20 0.36

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
SCHEMBL31129962 0.85 NR1H2 (0.45) GPR119NR1H2CHRM4DRD2HTR7
SCHEMBL17795342 0.84 GPR119 (0.48) GPR119NR1H2CHRM4DRD2HTR7
SCHEMBL30727224 0.84 GPR119 (0.48) GPR119NR1H2CHRM4DRD2HTR7
SCHEMBL31665491 0.83 DHODH (0.43) GPR119NR1H2CHRM4DRD2HTR7
SCHEMBL25143306 0.83 DHODH (0.43) GPR119NR1H2CHRM4DRD2HTR7
SCHEMBL3915174 0.83 GPR119 (0.51) GPR119NR1H2CHRM4DRD2HTR7
SCHEMBL12359678 0.82 GPR119 (0.46) GPR119NR1H2CHRM4DRD2HTR7
SCHEMBL17794892 0.82 GPR119 (0.50) GPR119NR1H2CHRM4DRD2HTR7
SCHEMBL25143267 0.81 CHRM4 (0.42) GPR119NR1H2CHRM4DRD2HTR7
SCHEMBL12359663 0.80 GPR119 (0.45) GPR119CHRM4DRD2HTR7DHODH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8003624-B2 Functionally selective ALPHA2C adrenoreceptor agonists SCHERING CORPORATION (US) 2011-08-23 US disclosed
US-8003624-B2 Functionally selective ALPHA2C adrenoreceptor agonists SCHERING CORPORATION (US) 2011-08-23 US disclosed
EP-1945626-B1 IMIDAZOLE DERIVATIVES AS FUNCTIONALLY SELECTIVE ALPHA2C ADRENORECEPTOR AGONISTS SCHERING CORP (US) 2011-07-27 EP disclosed
US-7803828-B2 Functionally selective alpha2C adrenoreceptor agonists SCHERING-PLOUGH CORPORATION (US) 2010-09-28 US disclosed
US-7803828-B2 Functionally selective alpha2C adrenoreceptor agonists SCHERING-PLOUGH CORPORATION (US) 2010-09-28 US disclosed
WO-2008100457-A2 FUNCTIONALLY SELECTIVE ALPHA2C ADRENORECEPTOR AGONISTS SCHERING CORPORATION (US) 2008-08-21 WO disclosed
US-20080027100-A1 Functionally selective alpha2C adrenoreceptor agonists SCHERING CORPORATION AND PHARMACOPEIA, INC. 2008-01-31 US disclosed
US-20080027100-A1 Functionally selective alpha2C adrenoreceptor agonists SCHERING CORPORATION AND PHARMACOPEIA, INC. 2008-01-31 US disclosed
US-20070099872-A1 Functionally selective alpha2C adrenoreceptor agonists SCHERING CORPORATION 2007-05-03 US disclosed
US-20070099872-A1 Functionally selective alpha2C adrenoreceptor agonists SCHERING CORPORATION 2007-05-03 US disclosed
WO-2007024944-A1 IMIDAZOLE DERIVATIVES AS FUNCTIONALLY SELECTIVE ALPHA2C ADRENORECEPTOR AGONISTS SCHERING CORPORATION (US) 2007-03-01 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-20080027100-A1 Functionally selective alpha2C adrenoreceptor agonists ADRA2C, ADRB2, ADRA2A GPR119 99/4885NR1H2 172/4885CHRM4 96/4885
US-20070099872-A1 Functionally selective alpha2C adrenoreceptor agonists ADRA2C, ADRB2, ADRA2A GPR119 99/4885NR1H2 172/4885CHRM4 96/4885

“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.