SCHEMBL7232146

SCHEMBL7232146

CN(C(=O)c1cn2c(nc3ccccc32)s1)C1CCCCC1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 3/20 0.61
PTAFR P25105 1/20 0.51
HPGD P15428 2/20 0.50
ALDH1A1 P00352 2/20 0.50
MAPT P10636 1/20 0.50
KLK7 P49862 1/20 0.49
TSHR P16473 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
TP53 P04637 1/20 0.43
HRH3 Q9Y5N1 5/20 0.43
KCNH2 Q12809 2/20 0.43
PIK3CA P42336 1/20 0.41

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
SCHEMBL6901283 0.86 GRM1 (0.47) GRM1PTAFRHPGDALDH1A1MAPT
SCHEMBL6901288 0.86 GRM1 (0.47) GRM1PTAFRHPGDALDH1A1MAPT
Hydrochloric Acid SCHEMBL7235500 0.84 ALDH1A1 (0.66) GRM1PTAFRHPGDALDH1A1MAPT
Hydrochloric Acid SCHEMBL7235509 0.84 MAPT (0.58) GRM1HPGDALDH1A1MAPTKLK7
Hydrochloric Acid SCHEMBL7232026 0.82 GRM1 (0.72) GRM1PTAFRHPGDALDH1A1MAPT
Hydrochloric Acid SCHEMBL7232011 0.82 GRM1 (0.62) GRM1PTAFRHPGDALDH1A1MAPT
Hydrochloric Acid SCHEMBL7233116 0.81 GRM1 (0.71) GRM1PTAFRHPGDALDH1A1MAPT
SCHEMBL7232093 0.81 GRM1 (0.54) GRM1HPGDALDH1A1MAPTKLK7
Hydrochloric Acid SCHEMBL7233125 0.81 GRM1 (0.61) GRM1PTAFRHPGDALDH1A1MAPT
SCHEMBL7232085 0.81 GRM1 (0.61) GRM1HPGDALDH1A1MAPTKLK7

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
US-6642264-B1 Thiazolo(3,2-a)benzoimidazole derivatives act specifically on metabotropic glutamate receptors and are used as medicaments. YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 2003-11-04 US disclosed
EP-1167369-A1 NOVEL THIAZOLOBENZIMIDAZOLE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2002-01-02 EP disclosed