SCHEMBL28052065

SCHEMBL28052065

[CH2]C(CC(=O)O)OCCC

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 4/20 0.35
FFAR3 O14843 2/20 0.33
SLC22A6 Q4U2R8 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
CYP2C19 P33261 1/20 0.33
HCAR2 Q8TDS4 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
PGD P52209 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
CYP1A2 P05177 1/20 0.31
LMNA P02545 1/20 0.31
PAM P19021 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
SCHEMBL22129515 0.88 GPR84 (0.41) GPR84SLC22A6HCAR2CYP1A2PAM
SCHEMBL27735602 0.83 ALDH1A1 (0.37) TDP1
SCHEMBL211006 0.82
SCHEMBL211364 0.82 ALDH1A1 (0.41) SLC22A6
SCHEMBL5454693 0.81 TSHR (0.39) GPR84
SCHEMBL3788751 0.76 GPR84 (0.36) GPR84FFAR3SLC22A6HDAC3HDAC1
SCHEMBL8034253 0.74 TDP1 (0.37) GPR84FFAR3SLC22A6HDAC3HDAC1
SCHEMBL498556 0.74 CYP1A2 (0.38) GPR84FFAR3SLC22A6HDAC3HDAC1
SCHEMBL9125222 0.74 GPR84 (0.35) GPR84FFAR3SLC22A6HDAC3HDAC1
SCHEMBL26007106 0.72 GPR84 (0.34) GPR84FFAR3SLC22A6HDAC3HDAC1

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
CN-102471553-B Fluorine-containing copolymer composition and method for producing same ASAHI GLASS CO.,LTD. (JP) 2016-02-10 CN disclosed