SCHEMBL8942426

SCHEMBL8942426

CC(CN(O)C(=O)Cc1cccc(Oc2ccc(Cl)cc2)c1)NC(N)=O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.44
PPARA Q07869 1/20 0.44
PTGES O14684 1/20 0.43
ACACB O00763 3/20 0.41
NPY5R Q15761 1/20 0.39
FDFT1 P37268 1/20 0.39
DAGLA Q9Y4D2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
FAAH O00519 1/20 0.39
ACACA Q13085 3/20 0.39
P2RX3 P56373 2/20 0.39
ALOX5 P09917 2/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL8782273 0.91 ACACB (0.45) PPARGPPARAPTGESACACBNPY5R
SCHEMBL8942682 0.74 SMN1; SMN2 (0.53) PTGESALDH1A1ACACAALOX5LMNA
SCHEMBL8783389 0.73 LTA4H (0.46) PPARGPPARAPTGESNPY5RFDFT1
SCHEMBL12440458 0.72 P2RX3 (0.58) PPARGPPARAFDFT1DAGLAALDH1A1
SCHEMBL9262220 0.72 PPARG (0.56) PPARGPPARAFDFT1DAGLAALDH1A1
SCHEMBL8782953 0.71 ALOX5 (0.42) PPARGPPARAALDH1A1P2RX3ALOX5
SCHEMBL1421946 0.71 PPARG (0.61) PPARGPPARADAGLAFAAHP2RX3
SCHEMBL8942608 0.70 FDFT1 (0.48) PTGESFDFT1ALOX5
SCHEMBL8942651 0.70 PTGES (0.48) PPARGPPARAPTGESACACBNPY5R
SCHEMBL8783189 0.69 DAGLA (0.47) PPARGPPARAPTGESDAGLAALDH1A1

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-5514702-A Arylamidoalkyl-N-hydroxyurea compounds having lipoxygenase inhibitory activity ABBOTT LABORATORIES (US) 1996-05-07 US disclosed