SCHEMBL4692276

SCHEMBL4692276

NC1(C(=O)O)CC2CC1C2C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 16/20 1.00
GRM6 O15303 13/20 1.00
GRM3 Q14832 13/20 1.00
GRM5 P41594 4/20 1.00
GRM4 Q14833 4/20 1.00
GRM1 Q13255 3/20 1.00
GRM8 O00222 6/20 0.44
SLC6A4 P31645 1/20 0.44

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
SCHEMBL13319986 0.82 GRM1 (1.00) GRM2GRM6GRM3GRM5GRM4
SCHEMBL6738759 0.82 GRM1 (1.00) GRM2GRM6GRM3GRM5GRM4
SCHEMBL8425584 0.72 GRM2 (0.56) GRM2GRM6GRM3GRM5GRM4
SCHEMBL8425583 0.72 GRM2 (0.56) GRM2GRM6GRM3GRM5GRM4
SCHEMBL10577620 0.70 GRM1 (0.62) GRM2GRM6GRM3GRM5GRM4
SCHEMBL670022 0.70 GRM1 (0.62) GRM2GRM6GRM3GRM5GRM4
SCHEMBL25660648 0.70 GRM1 (0.62) GRM2GRM6GRM3GRM5GRM4
SCHEMBL10621923 0.69 GRM2 (0.53) GRM2GRM6GRM3GRM5GRM4
SCHEMBL21983822 0.68 GRM2 (0.52) GRM2GRM6GRM3GRM5GRM4
SCHEMBL2562686 0.67 GRM2 (0.50) GRM2GRM6GRM3GRM5GRM4

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-8609721-B2 Ligands for metabotropic glutamate receptors and inhibitors of NAALADase GEORGETOWN UNIVERSITY (US) 2013-12-17 US disclosed
US-20080176821-A1 LIGANDS FOR METABOTROPIC GLUTAMATE RECEPTORS AND INHIBITORS OF NAALADASE GEORGETOWN UNIVERSITY 2008-07-24 US disclosed
US-6528499-B1 Ligands for metabotropic glutamate receptors and inhibitors of NAALADase GEORGETOWN UNIVERSITY 2003-03-04 US disclosed
US-6479470-B1 NAAG AND NAALADASE HAVE BEEN IMPLICATED IN SEVERAL PATHOLOGICAL CONDITIONS RELATING TO GLUTAMATE ABNORMALITIES AND NEUROTOXICITY GEORGETOWN UNIVERSITY 2002-11-12 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-20080176821-A1 LIGANDS FOR METABOTROPIC GLUTAMATE RECEPTORS AND INHIBITORS OF NAALADASE GRM3, GRM2, GRM1 GRM2 2/4885GRM6 9/4885GRM3 1/4885

“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.