SCHEMBL9504796

SCHEMBL9504796

CCCCCCCCC=Cc1cccc(C(=O)N(CCCC(=O)O)OCc2ccccc2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OXER1 Q8TDS5 2/20 0.41
PPARA Q07869 3/20 0.41
CYSLTR2 Q9NS75 2/20 0.39
CYSLTR1 Q9Y271 2/20 0.39
FAAH O00519 1/20 0.39
EPHX2 P34913 1/20 0.39
ALDH1A1 P00352 4/20 0.39
F7 P08709 3/20 0.39
F3 P13726 3/20 0.39
PPARG P37231 2/20 0.39
PPARD Q03181 2/20 0.39
LMNA P02545 2/20 0.39
ALOX15 P16050 2/20 0.39
HSD17B10 Q99714 2/20 0.39
DUSP3 P51452 1/20 0.39
PTPN7 P35236 1/20 0.39
KDM4E B2RXH2 1/20 0.39
FFAR1 O14842 1/20 0.39
FABP3 P05413 1/20 0.39
CYP3A4 P08684 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
SCHEMBL9504782 1.00 OXER1 (0.41) OXER1PPARACYSLTR2CYSLTR1FAAH
SCHEMBL9504708 0.90 OXER1 (0.41) OXER1PPARACYSLTR2CYSLTR1FAAH
SCHEMBL9504718 0.90 OXER1 (0.41) OXER1PPARACYSLTR2CYSLTR1FAAH
SCHEMBL9506831 0.88 EPHX2 (0.42) OXER1PPARAFAAHEPHX2ALDH1A1
SCHEMBL9506810 0.88 EPHX2 (0.42) OXER1PPARAFAAHEPHX2ALDH1A1
SCHEMBL9504823 0.87 EPHX2 (0.43) OXER1PPARAFAAHEPHX2ALDH1A1
SCHEMBL9504827 0.87 EPHX2 (0.43) OXER1PPARAFAAHEPHX2ALDH1A1
SCHEMBL9508184 0.84 TNNC1 (0.41) FAAHEPHX2KDM4ECYP3A4CYP1A2
SCHEMBL9506238 0.83 PPARG (0.44) OXER1PPARAFAAHALDH1A1F7
SCHEMBL9506244 0.83 PPARG (0.44) OXER1PPARAFAAHALDH1A1F7

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0161939-B1 ARYLHYDROXAMATES E.R. Squibb & Sons, Inc. (US) 1993-07-21 EP disclosed
US-4607053-A L2POXYGENASE INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1986-08-19 US disclosed
EP-0161939-A2 Arylhydroxamates E.R. Squibb & Sons, Inc. (US) 1985-11-21 EP disclosed