SCHEMBL4071767

SCHEMBL4071767

Clc1cccc(-c2noc(C3CCCCN3)n2)c1

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 2/20 0.69
GRM5 P41594 15/20 0.54
HCRTR1 O43613 1/20 0.49
HCRTR2 O43614 1/20 0.49
MAPT P10636 1/20 0.49

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
SCHEMBL8272755 0.96 NR1H4 (0.68) NR1H4GRM5HCRTR1HCRTR2MAPT
SCHEMBL8272720 0.96 NR1H4 (0.68) NR1H4GRM5HCRTR1HCRTR2MAPT
SCHEMBL8245030 0.96 NR1H4 (0.68) NR1H4GRM5HCRTR1HCRTR2MAPT
Hydrochloric Acid SCHEMBL4956639 0.95 NR1H4 (0.67) NR1H4GRM5HCRTR1HCRTR2MAPT
Hydrochloric Acid SCHEMBL4955423 0.95 NR1H4 (0.67) NR1H4GRM5HCRTR1HCRTR2MAPT
Hydrochloric Acid SCHEMBL4955420 0.95 NR1H4 (0.67) NR1H4GRM5HCRTR1HCRTR2MAPT
SCHEMBL8242963 0.85 NR1H4 (0.69) NR1H4GRM5
SCHEMBL8236561 0.85 NR1H4 (0.69) NR1H4GRM5
SCHEMBL8242912 0.85 NR1H4 (0.69) NR1H4GRM5
SCHEMBL1061407 0.84 NR1H4 (0.74) NR1H4

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 9 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
WO-2007039781-A2 NEW COMPOUNDS Richter Gedeon Vegyészeti Gyár Rt. (HU) 2007-04-12 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-20070259916-A1 mGluR5 modulators II GRM5, GRM2, GRIK5 NR1H4 299/4885GRM5 1/4885HCRTR1 239/4885

“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.