SCHEMBL514962

SCHEMBL514962

CC(C)(C)OC(=O)N1CCC(=Cc2noc(-c3ccccc3)n2)CC1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.46
GRM5 P41594 1/20 0.45
CKS1B P61024 2/20 0.45
SKP1 P63208 2/20 0.45
SKP2 Q13309 2/20 0.45
SCD5 Q86SK9 1/20 0.43
GBA1 P04062 1/20 0.42
HDAC4 P56524 1/20 0.41
USP30 Q70CQ3 2/20 0.40
JAK2 O60674 1/20 0.40
JAK3 P52333 1/20 0.40
ABCB1 P08183 1/20 0.39
ABCG2 Q9UNQ0 1/20 0.39
KIT P10721 1/20 0.39
HPGDS O60760 1/20 0.39

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
SCHEMBL513734 0.96 CKS1B (0.44) GPR119GRM5CKS1BSKP1SKP2
SCHEMBL513733 0.96 CKS1B (0.44) GPR119GRM5CKS1BSKP1SKP2
SCHEMBL512326 0.94 GPR119 (0.42) GPR119GRM5CKS1BSKP1SKP2
SCHEMBL512855 0.94 GPR119 (0.42) GPR119GRM5CKS1BSKP1SKP2
SCHEMBL512327 0.94 GPR119 (0.42) GPR119GRM5CKS1BSKP1SKP2
SCHEMBL513481 0.89 GPR119 (0.43) GPR119CKS1BSKP1SKP2SCD5
SCHEMBL513177 0.81 HDAC4 (0.53) GPR119GRM5CKS1BSKP1SKP2
SCHEMBL387529 0.78 CKS1B (0.56) GPR119CKS1BSKP1SKP2SCD5
SCHEMBL18280165 0.77 USP30 (0.47) GPR119GRM5CKS1BSKP1SKP2
SCHEMBL1473227 0.76 GPR119 (0.51) GPR119GRM5CKS1BSKP1SKP2

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-20120028931-A1 HETEROCYCLIC M-GLU5 ANTAGONISTS RECORDATI IRELAND LIMITED (IE) 2012-02-02 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-20120028931-A1 HETEROCYCLIC M-GLU5 ANTAGONISTS OPRM1, GRM5, OPRD1 GPR119 674/4885GRM5 2/4885CKS1B 1061/4885

“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.