SCHEMBL5021679

SCHEMBL5021679

CNc1ncc(-c2cccc([C@H]3NC(=O)O[C@@H]3c3cccc(OC)c3)c2)cn1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 17/20 0.56
MAP4K4 O95819 1/20 0.40
CA12 O43570 1/20 0.37
CA9 Q16790 1/20 0.37

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
SCHEMBL5021739 0.86 GRM5 (0.69) GRM5
SCHEMBL16364178 0.85 GRM5 (0.73) GRM5
SCHEMBL5021980 0.85 GRM5 (0.60) GRM5
SCHEMBL13641847 0.85 GRM5 (0.55) GRM5
SCHEMBL5022012 0.84 GRM5 (0.57) GRM5
SCHEMBL5021840 0.84 GRM5 (0.57) GRM5
SCHEMBL5021719 0.84 GRM5 (0.56) GRM5
SCHEMBL5022105 0.84 GRM5 (0.56) GRM5
SCHEMBL5021912 0.84 GRM5 (0.73) GRM5
SCHEMBL5021381 0.84 GRM5 (0.73) GRM5

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
US-20120283264-A1 Oxazolidinones as Modulators of MGLUR5 BRISTOL-MYERS SQUIBB COMPANY 2012-11-08 US disclosed
WO-2012064603-A1 OXAZOLIDINONES AS MODULATORS OF MGLUR5 BRISTOL-MYERS SQUIBB COMPANY (US) 2012-05-18 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 (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-20120283264-A1 Oxazolidinones as Modulators of MGLUR5 GRM5, GRIK5, GRM1 GRM5 1/4885MAP4K4 1310/4885CA12 4689/4885

“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.