SCHEMBL5128070

SCHEMBL5128070

CC(C)(C)OC(=O)N1CCN(c2cncnc2C#N)CC1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.49
EGLN2 Q96KS0 1/20 0.46
SMARCA2 P51531 1/20 0.45
SMARCA4 P51532 1/20 0.45
PBRM1 Q86U86 1/20 0.45
CKS1B P61024 1/20 0.45
SKP1 P63208 1/20 0.45
SKP2 Q13309 1/20 0.45
MAP4K4 O95819 1/20 0.43
NR1H2 P55055 1/20 0.43
NR1H3 Q13133 1/20 0.43
ADK P55263 1/20 0.43

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
SCHEMBL25256362 0.82 GPR119 (0.49) GPR119SMARCA2SMARCA4PBRM1CKS1B
SCHEMBL30931005 0.81 KCNH2 (0.47) GPR119EGLN2SMARCA2SMARCA4PBRM1
SCHEMBL29182776 0.81 KCNH2 (0.47) GPR119EGLN2SMARCA2SMARCA4PBRM1
SCHEMBL24989545 0.81 GPR119 (0.47) GPR119EGLN2SMARCA2SMARCA4PBRM1
SCHEMBL31652007 0.81 POLB (0.54) GPR119EGLN2SMARCA2SMARCA4PBRM1
SCHEMBL26669527 0.80 GPR119 (0.47) GPR119SMARCA2SMARCA4PBRM1CKS1B
SCHEMBL25248459 0.80 GPR119 (0.47) GPR119SMARCA2SMARCA4PBRM1CKS1B
SCHEMBL28939463 0.79 GPR119 (0.51) GPR119EGLN2MAP4K4NR1H2NR1H3
SCHEMBL13261305 0.79 GPR119 (0.65) GPR119EGLN2CKS1BSKP1SKP2
SCHEMBL29232173 0.78 GPR119 (0.47) GPR119EGLN2SMARCA2SMARCA4PBRM1

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
US-20080312246-A1 Substituted Piperazines as Metabotropic Glutamate Receptor Antagonists ASTRAZENECA AB (SE) 2008-12-18 US disclosed
US-20080312246-A1 Substituted Piperazines as Metabotropic Glutamate Receptor Antagonists ASTRAZENECA AB (SE) 2008-12-18 US disclosed
WO-2007021573-A1 SUBSTITUTED PIPERAZINES AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS ASTRAZENECA AB (SE) 2007-02-22 WO disclosed
US-20070037820-A1 Substituted piperazines as metabotropic glutamate receptor antagonists ASTRAZENECA AB (SE) 2007-02-15 US disclosed
US-20070037820-A1 Substituted piperazines as metabotropic glutamate receptor antagonists ASTRAZENECA AB (SE) 2007-02-15 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 (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-20080312246-A1 Substituted Piperazines as Metabotropic Glutamate Receptor Antagonists GRM5, GRM1, GRM2 GPR119 90/4885EGLN2 1103/4885SMARCA2 4068/4885
US-20070037820-A1 Substituted piperazines as metabotropic glutamate receptor antagonists GRM5, GRM1, GRM2 GPR119 90/4885EGLN2 1103/4885SMARCA2 4068/4885

“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.