SCHEMBL6250787

SCHEMBL6250787

C=C(COC(=O)NC)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.41
CHRNA4 P43681 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
MAPK1 P28482 1/20 0.41
CHRNA7 P36544 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 1/20 0.39
APEX1 P27695 1/20 0.39
EPHX1 P07099 1/20 0.39
ALOX15 P16050 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TET2 Q6N021 4/20 0.33
TET3 O43151 1/20 0.31
TET1 Q8NFU7 1/20 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
SCHEMBL14587495 0.81 CHRNB2 (0.39) CHRNB2CHRNA4CHRM2CHRM4CHRM5
SCHEMBL6251963 0.79 CHRNB2 (0.47) CHRNB2CHRNA4CHRM2CHRM4CHRM5
SCHEMBL14587489 0.79 CHRNB2 (0.38) CHRNB2CHRNA4CHRM2CHRM4CHRM5
SCHEMBL6249477 0.79 CHRNB2 (0.40) CHRNB2CHRNA4SMN1; SMN2EPHX1ALOX15
SCHEMBL14773506 0.77
SCHEMBL12199649 0.77
SCHEMBL6249673 0.76 EPHX1 (0.52) CHRNB2CHRNA4CHRM2CHRM4CHRM5
SCHEMBL6253105 0.75 EPHX1 (0.55) CHRNB2CHRNA4CHRM2CHRM4CHRM5
SCHEMBL352316 0.75 ALDH1A1 (0.42) CHRNB2CHRNA4CHRM2CHRM4CHRM5
SCHEMBL22029715 0.74 CHRNB2 (0.41) CHRNB2CHRNA4CHRM2CHRM4CHRM5

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
WO-2005047234-A1 METHOD FOR PRODUCING CARBAMATE GROUP-CONTAINING (METH)ACRYLIC ESTERS Röhm GmbH & Co. KG (DE) 2005-05-26 WO disclosed