SCHEMBL3294375

SCHEMBL3294375

CCCCCCCCCCCCCCCC(O)C1(C(=O)O)CC1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 8/20 0.50
FFAR1 O14842 2/20 0.50
FFAR4 Q5NUL3 1/20 0.46
MAPT P10636 1/20 0.44
LCK P06239 1/20 0.44
PPARD Q03181 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44
ACE2 Q9BYF1 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
SCHEMBL17099453 1.00 GPR84 (0.50) GPR84FFAR1FFAR4MAPTLCK
SCHEMBL7061809 0.84 GPR84 (0.44) GPR84FFAR1FFAR4MAPTLCK
SCHEMBL7438181 0.84 CA2 (0.37) GPR84FFAR1FFAR4
SCHEMBL1239842 0.80 GPR84 (0.41) GPR84FFAR1FFAR4MAPTLCK
SCHEMBL3689927 0.78 SPHK1 (0.49)
SCHEMBL22033716 0.77 GPR84 (0.39) GPR84FFAR1FFAR4MAPTLCK
SCHEMBL20341607 0.76 GPR84 (0.44) GPR84FFAR1FFAR4MAPTLCK
SCHEMBL2051821 0.76 GPR84 (0.44) GPR84FFAR1FFAR4MAPTLCK
SCHEMBL17818503 0.76 GPR84 (0.41) GPR84FFAR1FFAR4MAPTLCK
SCHEMBL20168856 0.76 FFAR3 (0.35)

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-20100086611-A1 Method for Treating Infectious Organisms Normally Considered to be Resistant to an Antimicrobial Drug BAXTER INTERNATIONAL INC. (US) 2010-04-08 US claimed