SCHEMBL513293

SCHEMBL513293

Cc1noc(C=C2CCN(C(=O)OC(C)(C)C)CC2)n1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.46
GPR119 Q8TDV5 6/20 0.44
USP2 O75604 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HDAC4 P56524 1/20 0.41
RECQL P46063 1/20 0.38
SCD5 Q86SK9 1/20 0.38
HPGD P15428 1/20 0.36
POLB P06746 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ESR2 Q92731 1/20 0.36
ADORA1 P30542 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
SCHEMBL514361 0.84 GRM5 (0.41) GRM5GPR119USP2SMN1; SMN2HDAC4
SCHEMBL513177 0.81 HDAC4 (0.53) GRM5GPR119SMN1; SMN2HDAC4SCD5
SCHEMBL513744 0.78 GBA1 (0.51) GRM5GPR119HDAC4
SCHEMBL513815 0.77 GRM5 (0.47) GRM5GPR119USP2SMN1; SMN2SCD5
SCHEMBL513325 0.76 KCNH2 (0.49) GRM5HDAC4KMT2A
SCHEMBL21723194 0.75 GRM5 (0.43) GRM5GPR119USP2SMN1; SMN2RECQL
SCHEMBL2899012 0.72 GPR119 (0.53) GPR119USP2SMN1; SMN2RECQLHPGD
SCHEMBL24673913 0.72 USP2 (0.51) GRM5GPR119USP2SMN1; SMN2RECQL
SCHEMBL10253506 0.72 USP2 (0.51) GRM5GPR119USP2SMN1; SMN2RECQL
SCHEMBL24102957 0.72 USP2 (0.49) GRM5GPR119USP2SMN1; SMN2RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2477981-A1 HETEROCYCLIC MGLU5 ANTAGONISTS Recordati Ireland Limited (IE) 2012-07-25 EP disclosed
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 GRM5 2/4885GPR119 674/4885USP2 3153/4885

“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.