SCHEMBL2890589

SCHEMBL2890589

Cn1c(-c2ccc(=O)n(C)n2)nnc1N1CCCC1c1cc(-c2cccc(F)c2)on1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 12/20 0.37
HRH3 Q9Y5N1 4/20 0.35
CNR2 P34972 1/20 0.35
SCD5 Q86SK9 1/20 0.35
NTRK1 P04629 1/20 0.35
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34

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
SCHEMBL2890585 1.00 GRM5 (0.37) GRM5HRH3CNR2SCD5NTRK1
SCHEMBL2897993 0.90 SMN1; SMN2 (0.41) GRM5HCRTR1HCRTR2
SCHEMBL2897988 0.90 SMN1; SMN2 (0.41) GRM5HCRTR1HCRTR2
SCHEMBL2890592 0.86 GRM5 (0.38) GRM5CNR2SCD5HCRTR1HCRTR2
SCHEMBL2890586 0.86 GRM5 (0.38) GRM5CNR2SCD5HCRTR1HCRTR2
SCHEMBL2896447 0.83 GRM5 (0.44) GRM5CNR2SCD5HCRTR1HCRTR2
SCHEMBL2896453 0.83 GRM5 (0.44) GRM5CNR2SCD5HCRTR1HCRTR2
SCHEMBL2898874 0.82 GRM5 (0.46) GRM5HRH3CNR2HCRTR1HCRTR2
SCHEMBL2898886 0.82 GRM5 (0.46) GRM5HRH3CNR2HCRTR1HCRTR2
SCHEMBL2899532 0.78 GRM5 (0.42) GRM5HCRTR1HCRTR2

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-7678796-B2 MGluR5 modulators I ASTRAZENECA AB (SE) 2010-03-16 US claimed
US-20070259862-A1 MGluR5 modulators I ASTRAZENECA AB (SE) 2007-11-08 US claimed
US-7678796-B2 MGluR5 modulators I ASTRAZENECA AB (SE) 2010-03-16 US disclosed
US-20070259862-A1 MGluR5 modulators I 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-20070259862-A1 MGluR5 modulators I GRM5, GRM1, GRIK5 GRM5 1/4885HRH3 362/4885CNR2 49/4885

“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.