SCHEMBL5489848

SCHEMBL5489848

Cc1c(C2=CCN(C(=O)O)CC2)nnn1-c1cccnc1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 20/20 0.55
GRM5 P41594 4/20 0.51
HRH1 P35367 1/20 0.51
TMEM97 Q5BJF2 1/20 0.51

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
SCHEMBL2892787 0.92 GRM1 (0.55) GRM1GRM5HRH1TMEM97
SCHEMBL2891852 0.89 GRM1 (0.51) GRM1GRM5HRH1TMEM97
SCHEMBL12975671 0.89 GRM1 (0.60) GRM1GRM5HRH1TMEM97
SCHEMBL12975607 0.86 GRM1 (0.69) GRM1GRM5HRH1TMEM97
SCHEMBL2885501 0.86 GRM1 (0.69) GRM1GRM5HRH1TMEM97
SCHEMBL2890559 0.79 GRM1 (0.78) GRM1GRM5HRH1TMEM97
SCHEMBL2890753 0.79 GRM1 (0.61) GRM1GRM5HRH1TMEM97
SCHEMBL2889708 0.77 GRM1 (0.59) GRM1GRM5HRH1TMEM97
SCHEMBL2885810 0.77 GRM1 (0.54) GRM1GRM5HRH1TMEM97
SCHEMBL2893262 0.76 GRM1 (0.73) GRM1GRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1764362-A1 BIARYL DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-03-21 EP disclosed
EP-1764362-A1 BIARYL DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-03-21 EP disclosed