SCHEMBL27557484

SCHEMBL27557484

CCCCC(O)CC(O)=S

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 8/20 0.52
FFAR1 O14842 2/20 0.41
FFAR4 Q5NUL3 1/20 0.41
CA2 P00918 1/20 0.37
MAPK1 P28482 1/20 0.37
NFKB1 P19838 1/20 0.35
ALDH1A1 P00352 1/20 0.34
TRPV1 Q8NER1 1/20 0.33
FAAH O00519 1/20 0.33
FDPS P14324 1/20 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
SCHEMBL9186346 0.91 GPR84 (0.64) GPR84FFAR1FFAR4NFKB1FAAH
SCHEMBL21550183 0.91 GPR84 (0.64) GPR84FFAR1FFAR4NFKB1FAAH
SCHEMBL28040890 0.91 GPR84 (0.64) GPR84FFAR1FFAR4NFKB1FAAH
SCHEMBL27504892 0.91 GPR84 (0.64) GPR84FFAR1FFAR4NFKB1FAAH
SCHEMBL28135484 0.89 GPR84 (0.62) GPR84FFAR1FFAR4NFKB1FAAH
SCHEMBL27694270 0.89 GPR84 (0.62) GPR84FFAR1FFAR4NFKB1FAAH
SCHEMBL27675783 0.89 GPR84 (0.62) GPR84FFAR1FFAR4NFKB1FAAH
SCHEMBL6433696 0.78 GPR84 (0.54) GPR84FFAR1FFAR4CA2MAPK1
SCHEMBL2168606 0.76 GPR84 (0.83) GPR84FFAR1FFAR4CA2MAPK1
SCHEMBL239580 0.76 GPR84 (0.83) GPR84FFAR1FFAR4CA2MAPK1

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-1350027-A Polymer composition containing halogen stabilized by crypto-thio-alcohol and mixture of zinc carboxylate and zinc chloride ROHM & HAAS (US) 2002-05-22 CN disclosed