SCHEMBL3068894

SCHEMBL3068894

CN(Cc1cccc(-c2ccc(CN3CC4(CCCCC4)OC3=O)cc2)c1)CC(C)(C)N

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 2/20 0.38
GRIN2B Q13224 2/20 0.38
GRM2 Q14416 6/20 0.37
HRH3 Q9Y5N1 1/20 0.35
AOC3 Q16853 7/20 0.34
TACR2 P21452 1/20 0.33
TACR1 P25103 1/20 0.33

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
SCHEMBL3057914 0.96 GRIN1 (0.38) GRIN1GRIN2BGRM2HRH3AOC3
SCHEMBL4209234 0.86 GRM2 (0.39) GRIN1GRIN2BGRM2HRH3AOC3
SCHEMBL3068898 0.86 GRIN1 (0.38) GRIN1GRIN2BGRM2AOC3TACR2
SCHEMBL3077038 0.83 AOC3 (0.42) GRIN1GRIN2BGRM2HRH3AOC3
SCHEMBL3079931 0.83 GRM2 (0.37) GRIN1GRIN2BGRM2HRH3AOC3
SCHEMBL3063936 0.81 GRIN1 (0.37) GRIN1GRIN2BGRM2HRH3AOC3
SCHEMBL3066747 0.81 CHKA (0.46) GRM2HRH3TACR2TACR1
SCHEMBL3076811 0.81 CHKA (0.46) GRM2HRH3TACR2TACR1
SCHEMBL3073001 0.80 GRM2 (0.44) GRIN1GRIN2BGRM2TACR2TACR1
SCHEMBL3077066 0.79 AOC3 (0.42) GRIN1GRIN2BGRM2HRH3AOC3

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-7790717-B2 administering 3-(4'-Morpholin-4-ylmethyl-biphenyl-4-ylmethyl)-1-oxa-3-aza-spiro[4.5]decan-2-one, for the treatment of schizophrenia ASTRAZENECA AB (SE) 2010-09-07 US disclosed
US-20090124578-A1 SPIRO-OXAZOLIDINONE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS ASTRAZENECA AB (SE) 2009-05-14 US disclosed
US-7485722-B2 Spiro-oxazolidinone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB (SE) 2009-02-03 US disclosed
US-20080125431-A1 Spiro-oxazolidinone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA (SE) 2008-05-29 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 (2 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-20090124578-A1 SPIRO-OXAZOLIDINONE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS GRM1, GRIN1, GRM2 GRIN1 2/4885GRIN2B 5/4885GRM2 3/4885
US-20080125431-A1 Spiro-oxazolidinone compounds and their use as metabotropic glutamate receptor potentiators GRM1, GRIN1, GRM2 GRIN1 2/4885GRIN2B 5/4885GRM2 3/4885

“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.