SCHEMBL1892479

SCHEMBL1892479

CC(OC(=O)OC1CC(=O)NC1=O)OC(=O)C1CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
TP53 P04637 1/20 0.31
RAB9A P51151 1/20 0.30
SYK P43405 1/20 0.30
KDM4E B2RXH2 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL638696 0.81
SCHEMBL1421996 0.81 CHRM2 (0.39) SMN1; SMN2CHRM2CHRM4CHRM1CHRM3
SCHEMBL978471 0.80
SCHEMBL612318 0.80
SCHEMBL1884135 0.77 ALDH1A1 (0.34) SMN1; SMN2KDM4E
SCHEMBL1892476 0.77 ALDH1A1 (0.34) KDM4E
SCHEMBL1891317 0.76 HSD17B10 (0.31) HSD17B10
SCHEMBL10650039 0.74 SMN1; SMN2 (0.44) LMNASMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL975944 0.74 GAA (0.39) LMNASMN1; SMN2TP53RAB9A
SCHEMBL2957623 0.74 GAA (0.39) LMNASMN1; SMN2TP53RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7935686-B2 Acyloxyalkyl carbamate prodrugs, methods of synthesis, and use XENOPORT, INC. (US) 2011-05-03 US disclosed
WO-2006050472-A2 ACYLOXYALKYL CARBAMATE PRODRUGS OF 3-AMINOPROPYLPHOSPHONOUS AND -PHOSPHINIC ACIDS XENOPORT, INC. (US) 2006-05-11 WO disclosed