SCHEMBL17427809

SCHEMBL17427809

CC(=O)OC(C)CC(O)CC(C)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 3/20 0.47
TSHR P16473 2/20 0.47
CHRM2 P08172 2/20 0.47
CHRM4 P08173 2/20 0.47
TBXA2R P21731 2/20 0.47
SMN1; SMN2 Q16637 3/20 0.45
MAPT P10636 3/20 0.45
GALR3 O60755 2/20 0.45
BLM P54132 1/20 0.45
TDP1 Q9NUW8 1/20 0.35
ALOX15 P16050 1/20 0.34
CYP19A1 P11511 1/20 0.33
ALDH1A1 P00352 3/20 0.32
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
CHRM5 P08912 2/20 0.31
CHRM3 P20309 2/20 0.31
PGR P06401 1/20 0.31
HTR1A P08908 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
SCHEMBL3751182 0.89 TSHR (0.52) CHRM1TSHRCHRM2CHRM4TBXA2R
SCHEMBL820672 0.83 TSHR (0.47) CHRM1TSHRCHRM2CHRM4TBXA2R
SCHEMBL10331178 0.81 TSHR (0.58) CHRM1TSHRCHRM2CHRM4TBXA2R
SCHEMBL18927916 0.80 TSHR (0.41) CHRM1TSHRCHRM2CHRM4TBXA2R
SCHEMBL14401391 0.79 ALOX15 (0.48) CHRM1TSHRCHRM2CHRM4TBXA2R
SCHEMBL15500033 0.79 TSHR (0.40) CHRM1TSHRCHRM2CHRM4TBXA2R
SCHEMBL766233 0.79 TSHR (0.56) CHRM1TSHRCHRM2CHRM4TBXA2R
SCHEMBL14087827 0.79 TSHR (0.56) CHRM1TSHRCHRM2CHRM4TBXA2R
SCHEMBL8958730 0.78 TSHR (0.42) CHRM1TSHRCHRM2CHRM4TBXA2R
SCHEMBL18932575 0.76 TSHR (0.37) CHRM1TSHRCHRM2CHRM4TBXA2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170166845-A1 ENCAPSULATED BENEFIT AGENT PARTICLES REVOLYMER (U.K.) LIMITED (GB) 2017-06-15 US disclosed
US-20170166845-A1 ENCAPSULATED BENEFIT AGENT PARTICLES REVOLYMER (U.K.) LIMITED (GB) 2017-06-15 US disclosed
WO-2016185202-A1 ENCAPSULATED BENEFIT AGENT PARTICLES REVOLYMER (U.K.) LIMITED (GB) 2016-11-24 WO disclosed
WO-2016005775-A1 ENCAPSULATED BENEFIT AGENT PARTICLES REVOLYMER (U.K.) LIMITED (GB) 2016-01-14 WO disclosed