SCHEMBL3134932

SCHEMBL3134932

CCCCCCCCCCCCCCC(O)C/C=C/O

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.54
FFAR4 Q5NUL3 2/20 0.54
GPR84 Q9NQS5 8/20 0.47
FAAH O00519 2/20 0.47
SPHK1 Q9NYA1 1/20 0.41
PSMD14 O00487 2/20 0.41
PLA2G1B P04054 2/20 0.41
MMP2 P08253 2/20 0.41
ATG4B Q9Y4P1 2/20 0.41
NFKB1 P19838 2/20 0.41
HSP90AA1 P07900 1/20 0.41
RAD52 P43351 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
LMNA P02545 1/20 0.40

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
SCHEMBL3134939 1.00 FFAR1 (0.54) FFAR1FFAR4GPR84FAAHSPHK1
SCHEMBL108529 0.98 FFAR1 (0.51) FFAR1FFAR4GPR84FAAHSPHK1
SCHEMBL108530 0.98 FFAR1 (0.51) FFAR1FFAR4GPR84FAAHSPHK1
SCHEMBL10583720 0.91 FFAR1 (0.45) FFAR1FFAR4GPR84FAAHPSMD14
SCHEMBL10583718 0.91 FFAR1 (0.45) FFAR1FFAR4GPR84FAAHPSMD14
SCHEMBL449788 0.89 FFAR1 (0.64) FFAR1FFAR4GPR84FAAHSPHK1
SCHEMBL449789 0.89 FFAR1 (0.64) FFAR1FFAR4GPR84FAAHSPHK1
SCHEMBL11864171 0.83 FFAR1 (0.58) FFAR1FFAR4GPR84FAAHSPHK1
SCHEMBL4104505 0.83 FFAR1 (0.58) FFAR1FFAR4GPR84FAAHSPHK1
SCHEMBL31216729 0.83 FFAR1 (0.58) FFAR1FFAR4GPR84FAAHSPHK1

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
US-20100009927-A1 Anti-Inflammatory and Anti-Allergy Extracts from Nettle HERBALSCIENCE GROUP LLC (US) 2010-01-14 US disclosed