SCHEMBL8524842

SCHEMBL8524842

CCCCCCCCCC(SCC)C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.50
GPR84 Q9NQS5 7/20 0.47
FFAR1 O14842 2/20 0.47
CA2 P00918 2/20 0.42
CA1 P00915 1/20 0.42
MAPT P10636 1/20 0.41
LCK P06239 1/20 0.41
PPARD Q03181 1/20 0.41
ZDHHC20 Q5W0Z9 1/20 0.41
ZDHHC2 Q9UIJ5 1/20 0.41
LAP3 P28838 1/20 0.40
GRIK1 P39086 1/20 0.40
GRIK2 Q13002 1/20 0.40
FFAR4 Q5NUL3 1/20 0.39
ACE2 Q9BYF1 1/20 0.39

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
SCHEMBL6063041 0.92 CA2 (0.50) EPHX1GPR84FFAR1CA2CA1
SCHEMBL9860473 0.87 EPHX1 (0.62) EPHX1GPR84FFAR1CA2CA1
SCHEMBL8417884 0.84 EPHX1 (0.48) EPHX1GPR84FFAR1CA2CA1
SCHEMBL8418221 0.84 EPHX1 (0.48) EPHX1GPR84FFAR1CA2CA1
SCHEMBL8419765 0.84 EPHX1 (0.48) EPHX1GPR84FFAR1CA2CA1
SCHEMBL8416695 0.84 EPHX1 (0.48) EPHX1GPR84FFAR1CA2CA1
SCHEMBL8419809 0.84 EPHX1 (0.48) EPHX1GPR84FFAR1CA2CA1
SCHEMBL8419972 0.84 EPHX1 (0.48) EPHX1GPR84FFAR1CA2CA1
SCHEMBL8416432 0.84 EPHX1 (0.48) EPHX1GPR84FFAR1CA2CA1
SCHEMBL8420007 0.84 EPHX1 (0.48) EPHX1GPR84FFAR1CA2CA1

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
WO-1999050229-A1 FATTY ACID ANALOGS AND PRODRUGS G.D. SEARLE & CO. (US) 1999-10-07 WO disclosed