SCHEMBL11524851

SCHEMBL11524851

CCCCCCCCC(O)CCCCCCCCCC(CCCC)C(N)=O

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 2/20 0.62
▸ CA1 P00915 1/20 0.62
▸ FFAR1 O14842 2/20 0.56
▸ FFAR4 Q5NUL3 1/20 0.56
▸ GPR84 Q9NQS5 8/20 0.53
▸ NFKB1 P19838 1/20 0.50
▸ GRIK1 P39086 2/20 0.47
▸ GRIK2 Q13002 2/20 0.47
▸ FAAH O00519 2/20 0.46
▸ SLC1A2 P43004 1/20 0.44
▸ SLC1A1 P43005 1/20 0.44

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
SCHEMBL3124369 0.98 CA2 (0.59) CA2CA1FFAR1FFAR4GPR84
SCHEMBL30829073 0.98 CA2 (0.59) CA2CA1FFAR1FFAR4GPR84
SCHEMBL4582551 0.98 CA2 (0.59) CA2CA1FFAR1FFAR4GPR84
SCHEMBL1531290 0.96 CA2 (0.57) CA2CA1FFAR1FFAR4GPR84
SCHEMBL3885719 0.94 CA2 (0.55) CA2CA1FFAR1FFAR4GPR84
SCHEMBL4582598 0.92 CA2 (0.57) CA2CA1FFAR1FFAR4GPR84
SCHEMBL1360883 0.92 CA2 (0.72) CA2CA1FFAR1GPR84GRIK1
SCHEMBL10885897 0.92 CA2 (0.72) CA2CA1FFAR1GPR84GRIK1
SCHEMBL8059908 0.92 CA2 (0.72) CA2CA1FFAR1GPR84GRIK1
SCHEMBL9625784 0.92 CA2 (0.72) CA2CA1FFAR1GPR84GRIK1

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-4153561-A Conditioning agent HOECHST AKTIENGESELLSCHAFT (DE) 1979-05-08 — — US disclosed
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