SCHEMBL9639334

SCHEMBL9639334

CC(N)OC(=O)NCCO

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.46
CHRNB4 P30926 2/20 0.46
CHRNA3 P32297 2/20 0.46
CHRNA4 P43681 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
MEN1 O00255 1/20 0.40
USP2 O75604 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
ACHE P22303 8/20 0.36
RAB9A P51151 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
EPHX1 P07099 1/20 0.31
ALOX15 P16050 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
SCHEMBL606535 0.83 CHRNB2 (0.49) CHRNB2CHRNB4CHRNA3CHRNA4SMN1; SMN2
SCHEMBL18591656 0.79 CHRNB2 (0.46) CHRNB2CHRNB4CHRNA3CHRNA4SMN1; SMN2
SCHEMBL20052073 0.79 CHRNB2 (0.46) CHRNB2CHRNB4CHRNA3CHRNA4SMN1; SMN2
SCHEMBL6934228 0.78
SCHEMBL10874284 0.78 CHRNB2 (0.45) CHRNB2CHRNB4CHRNA3CHRNA4SMN1; SMN2
SCHEMBL29045709 0.76 CHRNB2 (0.44) CHRNB2CHRNB4CHRNA3CHRNA4SMN1; SMN2
SCHEMBL20354392 0.76 CHRNB2 (0.44) CHRNB2CHRNB4CHRNA3CHRNA4SMN1; SMN2
SCHEMBL15463283 0.75 CHRNB2 (0.46) CHRNB2CHRNB4CHRNA3CHRNA4SMN1; SMN2
SCHEMBL19966770 0.73 GSR (0.46) MEN1KMT2ACYP3A4TSHR
SCHEMBL499171 0.72

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-0496168-A1 Process for the production of N-(2-hydroxyethyl)-2-imidazolidinone BP Chemicals Limited (GB) 1992-07-29 EP disclosed