SCHEMBL8418227

SCHEMBL8418227

CCCCCCOC(=O)C(CC)CCCCCCCCCC(O)CCCCCC

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.51
CA1 P00915 1/20 0.51
FFAR4 Q5NUL3 1/20 0.50
FFAR1 O14842 1/20 0.50
GPR84 Q9NQS5 5/20 0.47
NAAA Q02083 1/20 0.46
NFKB1 P19838 1/20 0.45
EPHX1 P07099 1/20 0.43
MAPK1 P28482 1/20 0.43
TSHR P16473 2/20 0.42
FAAH O00519 1/20 0.42

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
SCHEMBL8006383 0.93 FFAR1 (0.53) CA2FFAR4FFAR1GPR84NAAA
SCHEMBL7991094 0.93 FFAR1 (0.53) CA2FFAR4FFAR1GPR84NAAA
SCHEMBL1033880 0.93 FFAR1 (0.53) CA2FFAR4FFAR1GPR84NAAA
SCHEMBL19066841 0.93 FFAR1 (0.53) CA2FFAR4FFAR1GPR84NAAA
SCHEMBL7217255 0.93 CA2 (0.58) CA2CA1NAAAEPHX1MAPK1
SCHEMBL3454037 0.93 CA2 (0.58) CA2CA1NAAAEPHX1MAPK1
SCHEMBL7218993 0.93 CA2 (0.58) CA2CA1NAAAEPHX1MAPK1
SCHEMBL10936953 0.93 CA2 (0.58) CA2CA1NAAAEPHX1MAPK1
SCHEMBL7219194 0.93 CA2 (0.58) CA2CA1NAAAEPHX1MAPK1
SCHEMBL7218971 0.93 CA2 (0.58) CA2CA1NAAAEPHX1MAPK1

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-5959130-A OF CASTOR OIL, HYDROGENATED CASTOR OIL, RICINOLEIC ACID AND HYDROXY STEARIC ACID; DILUENTS, SOLVENTS, LOTIONS, SOLUBILIZERS, LIQUID CARRIERS, VEHICLES AND THE LIKE FOR COSMETICS AND TOILETRY FORMULATIONS FINETEX, INC. (US) 1999-09-28 US disclosed