SCHEMBL3119129

SCHEMBL3119129

O=[C]CCCCCCCCCCCCCCCCCCCCCO

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.39
FFAR1 O14842 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
LMNA P02545 2/20 0.38
ALDH1A1 P00352 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TSHR P16473 1/20 0.38
MIF P14174 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.32
CAMK2A Q9UQM7 1/20 0.30
FNTA P49354 1/20 0.30
FNTB P49356 1/20 0.30

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
SCHEMBL3127999 1.00 GPR84 (0.39) GPR84FFAR1FFAR4LMNAALDH1A1
SCHEMBL1958836 1.00 GPR84 (0.39) GPR84FFAR1FFAR4LMNAALDH1A1
SCHEMBL1170221 1.00 GPR84 (0.39) GPR84FFAR1FFAR4LMNAALDH1A1
SCHEMBL1961525 1.00 GPR84 (0.39) GPR84FFAR1FFAR4LMNAALDH1A1
SCHEMBL973119 1.00
SCHEMBL3124517 1.00 GPR84 (0.39) GPR84FFAR1FFAR4LMNAALDH1A1
SCHEMBL1957878 1.00 GPR84 (0.39) GPR84FFAR1FFAR4LMNAALDH1A1
SCHEMBL8920113 1.00 GPR84 (0.39) GPR84FFAR1FFAR4LMNAALDH1A1
SCHEMBL6125503 1.00
SCHEMBL6006382 1.00 GPR84 (0.39) GPR84FFAR1FFAR4LMNAALDH1A1

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