SCHEMBL990338

SCHEMBL990338

COc1ccc(Nc2ncc(C(=O)N3CCCCC3)cc2Cl)cn1

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 18/20 0.76
PIK3CA P42336 1/20 0.54
MTOR P42345 1/20 0.54
HPGD P15428 1/20 0.48

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
SCHEMBL992163 1.00 GRM5 (0.76) GRM5PIK3CAMTORHPGD
SCHEMBL990208 0.90 GRM5 (0.73) GRM5
SCHEMBL990873 0.88 GRM5 (0.78) GRM5PIK3CAMTOR
SCHEMBL990910 0.86 GRM5 (1.00) GRM5HPGD
SCHEMBL990813 0.86 GRM5 (1.00) GRM5HPGD
SCHEMBL990894 0.85 GRM5 (0.79) GRM5PIK3CAMTOR
SCHEMBL992711 0.83 GRM5 (0.76) GRM5
SCHEMBL990119 0.82 GRM5 (0.78) GRM5
SCHEMBL989516 0.82 GRM5 (0.78) GRM5
SCHEMBL990097 0.82 GRM5 (0.79) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140187600-A1 USE OF METABOTROPIC GLUTAMATE RECEPTORS GLATTHAR RALF (DE) 2014-07-03 US disclosed
US-20120309742-A1 USE OF METABOTROPIC GLUTAMATE RECEPTORS GLATTHAR RALF (DE) 2012-12-06 US disclosed
EP-2272509-A1 New Uses of metabotropic glutamate receptors Novartis AG (CH) 2011-01-12 EP disclosed
US-20090005363-A1 Organic Compounds NOVARTIS AG (CH) 2009-01-01 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 (3 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-20120309742-A1 USE OF METABOTROPIC GLUTAMATE RECEPTORS GRM5, GRM1, GRM2 GRM5 1/4885PIK3CA 3345/4885MTOR 1888/4885
US-20090005363-A1 Organic Compounds NNT, NAPRT, CHRNA5 GRM5 680/4885PIK3CA 1050/4885MTOR 2427/4885
US-20140187600-A1 USE OF METABOTROPIC GLUTAMATE RECEPTORS GRM5, GRM1, GRM2 GRM5 1/4885PIK3CA 3345/4885MTOR 1888/4885

“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.