SCHEMBL19033792

SCHEMBL19033792

CNC(=O)OCC(C)OC(=O)NC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.44
CHRNA4 P43681 2/20 0.44
MAPK1 P28482 2/20 0.41
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
CHRM5 P08912 1/20 0.41
CYP2D6 P10635 1/20 0.41
CHRM1 P11229 1/20 0.41
NFKB1 P19838 1/20 0.41
CHRM3 P20309 1/20 0.41
CHRNA7 P36544 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.39
LMNA P02545 1/20 0.39
APEX1 P27695 1/20 0.39
EPHX1 P07099 1/20 0.39
CYP1A2 P05177 1/20 0.37
TSHR P16473 3/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL18352648 0.84 TSHR (0.41) CHRNB2CHRNA4MAPK1CHRM2CHRM4
SCHEMBL967608 0.84
SCHEMBL19814584 0.83 CHRNB2 (0.40) CHRNB2CHRNA4MAPK1CHRM2CHRM4
SCHEMBL16250360 0.81 TSHR (0.61) CHRNB2CHRNA4MAPK1CHRM2CHRM4
SCHEMBL10821442 0.81 TSHR (0.61) CHRNB2CHRNA4MAPK1CHRM2CHRM4
SCHEMBL12054358 0.81 TSHR (0.52) CHRNB2CHRNA4MAPK1CHRM2CHRM4
SCHEMBL12780598 0.80 CHRNB2 (0.42) CHRNB2CHRNA4MAPK1CHRM2CHRM4
SCHEMBL18355149 0.80 HCAR2 (0.43) CHRNB2CHRNA4MAPK1CHRM2CHRM4
SCHEMBL18650145 0.79 CHRNB2 (0.48) CHRNB2CHRNA4MAPK1CHRM2CHRM4
SCHEMBL5244737 0.77

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
US-9688899-B2 Curable composition for use as lost circulation material DOW GLOBAL TECHNOLOGIES LLC (US) 2017-06-27 US disclosed