SCHEMBL2249679

SCHEMBL2249679

CC(=O)CC(=O)NCCOC(N)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.41
CHRM4 P08173 2/20 0.41
CHRM5 P08912 2/20 0.41
CHRM1 P11229 2/20 0.41
CHRM3 P20309 2/20 0.41
CHRNB2 P17787 2/20 0.41
CHRNA4 P43681 2/20 0.41
TSHR P16473 2/20 0.41
LMNA P02545 2/20 0.41
CYP2C19 P33261 2/20 0.41
HTR1A P08908 1/20 0.41
CHRNA7 P36544 1/20 0.41
ALOX15 P16050 1/20 0.38
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
FAAH O00519 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
SCHEMBL28969877 0.83 CHRM2 (0.39) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL14890563 0.83 FAAH (0.43) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL1683253 0.82 MGAM (0.44) TSHRCYP2C19ALOX15MGAMGAA
SCHEMBL14890445 0.82 FAAH (0.42) CHRM2CHRM4CHRM5CHRM1CHRM3
Hydrochloric Acid SCHEMBL25328852 0.82 CA2 (0.38) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL28337342 0.81 MAPK1 (0.46) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9784851 0.79 MTNR1A (0.38) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL25282552 0.79 ALDH1A1 (0.48) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL27997081 0.78 CA1 (0.40) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL25439321 0.78 CHRM2 (0.38) CHRM2CHRM4CHRM5CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7999015-B2 Curable aqueous composition KANSAI PAINT CO., LTD. (JP) 2011-08-16 US disclosed
US-20100230291-A1 CURABLE AQUEOUS COMPOSITION KANSAI PAINT CO., LTD. (JP) 2010-09-16 US disclosed
EP-2000489-B1 CURABLE AQUEOUS COMPOSITION KANSAI PAINT CO LTD (JP) 2010-07-28 EP disclosed
EP-2000489-A9 CURABLE AQUEOUS COMPOSITION Kansai Paint Co., Ltd. (JP) 2009-03-11 EP disclosed
EP-2000489-A2 CURABLE AQUEOUS COMPOSITION Kansai Paint Co., Ltd. (JP) 2008-12-10 EP disclosed