SCHEMBL4598341

SCHEMBL4598341

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

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.44
LMNA P02545 2/20 0.44
TSHR P16473 2/20 0.42
TDP1 Q9NUW8 1/20 0.39
TRPV1 Q8NER1 1/20 0.39
SLC22A6 Q4U2R8 1/20 0.39
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM1 P11229 1/20 0.38
TBXA2R P21731 1/20 0.38
MAPT P10636 2/20 0.36
GALR3 O60755 1/20 0.36
BLM P54132 1/20 0.36
MMP12 P39900 1/20 0.35
GABRR1 P24046 2/20 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
SCHEMBL28491605 0.77 TSHR (0.46) ALOX15SMN1; SMN2TSHRTDP1TRPV1
SCHEMBL28528169 0.77 TSHR (0.46) ALOX15SMN1; SMN2TSHRTDP1TRPV1
SCHEMBL15987193 0.77 SLC22A6 (0.42) SMN1; SMN2LMNATDP1SLC22A6MAPT
SCHEMBL7539461 0.77 TSHR (0.46) ALOX15SMN1; SMN2LMNATSHRTDP1
SCHEMBL886928 0.77 SLC22A6 (0.42) SMN1; SMN2LMNATDP1SLC22A6MAPT
SCHEMBL9789654 0.76 TSHR (0.41) ALOX15SMN1; SMN2TSHRSLC22A6MAPT
SCHEMBL16330194 0.76 ALOX15 (0.42) ALOX15SMN1; SMN2LMNATSHRTDP1
SCHEMBL9676795 0.75 CACNA2D1 (0.43) ALOX15SMN1; SMN2LMNATSHRTDP1
SCHEMBL4683182 0.75 ALOX15 (0.57) ALOX15SMN1; SMN2LMNATSHRTDP1
SCHEMBL10309227 0.75 ALOX15 (0.57) ALOX15SMN1; SMN2LMNATSHRTDP1

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-1858970-B1 BLOCKY HYDROXYETHYLCELLULOSE, DERIVATIVES THEREOF, PROCESS OF MAKING, AND USES THEREOF HERCULES INC (US) 2008-08-20 EP disclosed