SCHEMBL6706261

SCHEMBL6706261

O=C(O)CC(O)CCCCCCC1CO1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 4/20 0.53
ALDH1A1 P00352 1/20 0.41
SLC22A6 Q4U2R8 1/20 0.40
TBXA2R P21731 1/20 0.37
PTGFR P43088 1/20 0.37
PTGER2 P43116 1/20 0.37
FFAR4 Q5NUL3 1/20 0.36
FFAR1 O14842 1/20 0.36
GABRR1 P24046 2/20 0.35
LMNA P02545 1/20 0.35
TRPA1 O75762 1/20 0.33
ACACB O00763 1/20 0.33
ACACA Q13085 1/20 0.33
MAPT P10636 1/20 0.32
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
MMP12 P39900 1/20 0.32
MMP13 P45452 1/20 0.32
MMP14 P50281 1/20 0.32

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
SCHEMBL6706217 0.98 GPR84 (0.50) GPR84ALDH1A1SLC22A6TBXA2RPTGFR
SCHEMBL1139716 0.93 GPR84 (0.47) GPR84ALDH1A1SLC22A6TBXA2RPTGFR
SCHEMBL5056493 0.93 GPR84 (0.47) GPR84ALDH1A1SLC22A6TBXA2RPTGFR
SCHEMBL5056485 0.93 GPR84 (0.47) GPR84ALDH1A1SLC22A6TBXA2RPTGFR
SCHEMBL6706270 0.85 SLC22A6 (0.46) GPR84SLC22A6GABRR1LMNAMAPT
SCHEMBL5902983 0.83 ALDH1A1 (0.52) ALDH1A1TBXA2RPTGFRPTGER2FFAR4
SCHEMBL5903583 0.81 ALDH1A1 (0.48) ALDH1A1TBXA2RPTGFRPTGER2
SCHEMBL966415 0.77 GPR84 (0.74) GPR84SLC22A6FFAR4FFAR1GABRR1
SCHEMBL12758699 0.77 ALDH1A1 (0.55) GPR84ALDH1A1TBXA2RPTGFRPTGER2
SCHEMBL27674991 0.77 ALDH1A1 (0.55) GPR84ALDH1A1TBXA2RPTGFRPTGER2

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
JP-2004107603-A POLYLACTIC ACID BLEND POLYMER NAGOYA CITY 2004-04-08 JP disclosed