SCHEMBL4073239

SCHEMBL4073239

Cc1cc(-c2nnc(N3CCCCC3c3nc(-c4cccc(Cl)c4)no3)n2C)ccn1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 13/20 0.51
MAPT P10636 2/20 0.47
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HCRTR1 O43613 2/20 0.45
HCRTR2 O43614 2/20 0.45

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
SCHEMBL5486686 0.88 GRM5 (0.42) GRM5MAPTLMNASMN1; SMN2HCRTR1
SCHEMBL4070756 0.87 GRM5 (0.54) GRM5MAPTLMNASMN1; SMN2HCRTR1
SCHEMBL5628073 0.85 SMN1; SMN2 (0.39) GRM5SMN1; SMN2HCRTR1HCRTR2
SCHEMBL5398780 0.79 KCNH2 (0.45) GRM5MAPTLMNASMN1; SMN2HCRTR1
SCHEMBL5485273 0.79 GRM5 (0.42) GRM5MAPTLMNASMN1; SMN2HCRTR1
SCHEMBL5485899 0.78 MAPT (0.43) GRM5MAPTLMNASMN1; SMN2HCRTR1
SCHEMBL5483157 0.78 MAPT (0.43) GRM5MAPTLMNASMN1; SMN2HCRTR1
SCHEMBL5438651 0.78 MAPT (0.43) GRM5MAPTLMNASMN1; SMN2HCRTR1
SCHEMBL4377245 0.77 GRM5 (0.45) GRM5
SCHEMBL5450497 0.75 KCNH2 (0.42) GRM5SMN1; SMN2HCRTR1HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101437798-A Mglur5 modulators II ASTRAZENECA AB (SE) 2009-05-20 CN claimed
EP-2027090-A2 MGLUR5 MODULATORS II AstraZeneca AB (SE) 2009-02-25 EP claimed
WO-2007130821-A2 MGLUR5 MODULATORS II ASTRAZENECA AB (SE) 2007-11-15 WO claimed
US-20070259916-A1 mGluR5 modulators II ASTRAZENECA AB (SE) 2007-11-08 US claimed
WO-2007130821-A2 MGLUR5 MODULATORS II ASTRAZENECA AB (SE) 2007-11-15 WO disclosed
US-20070259916-A1 mGluR5 modulators II ASTRAZENECA AB (SE) 2007-11-08 US disclosed
US-20070259916-A1 mGluR5 modulators II ASTRAZENECA AB (SE) 2007-11-08 US disclosed
US-20070259916-A1 mGluR5 modulators II ASTRAZENECA AB (SE) 2007-11-08 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-20070259916-A1 mGluR5 modulators II GRM5, GRM2, GRIK5 GRM5 1/4885MAPT 797/4885LMNA 4579/4885

“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.