SCHEMBL14775274

SCHEMBL14775274

NC(=O)OCC1Cn2cc([N+](=O)[O-])nc2O1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 0.39
MITF O75030 1/20 0.34
GRM2 Q14416 4/20 0.34
KCNH2 Q12809 4/20 0.33
LMNA P02545 1/20 0.33
GLA P06280 1/20 0.32
ALDH1A1 P00352 2/20 0.31

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
SCHEMBL1229247 0.82 CHRM1 (0.42) CHRM1MITFGRM2KCNH2ALDH1A1
SCHEMBL5541985 0.80 CHRM1 (0.40) CHRM1MITFGRM2KCNH2ALDH1A1
SCHEMBL5539431 0.80 CHRM1 (0.44) CHRM1MITFGRM2KCNH2ALDH1A1
SCHEMBL5539172 0.79 CHRM1 (0.39) CHRM1MITFGRM2KCNH2ALDH1A1
SCHEMBL18031624 0.78 CHRM1 (0.41) CHRM1MITFGRM2KCNH2ALDH1A1
SCHEMBL1227391 0.78 CHRM1 (0.40) CHRM1GRM2KCNH2ALDH1A1
SCHEMBL5537422 0.77 CHRM1 (0.37) CHRM1MITFKCNH2ALDH1A1
SCHEMBL12901278 0.76 GRM2 (0.47) CHRM1GRM2KCNH2
SCHEMBL3466318 0.74 GRM2 (0.46) CHRM1GRM2KCNH2LMNAALDH1A1
SCHEMBL5538961 0.74 CHRM1 (0.35) CHRM1KCNH2LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2570418-A2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-03-20 EP disclosed