SCHEMBL17334530

SCHEMBL17334530

COC(=O)/C=C/CCCC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.48
PPARA Q07869 6/20 0.48
PPARD Q03181 4/20 0.48
TOP1 P11387 3/20 0.48
CYP19A1 P11511 3/20 0.48
KMT2A Q03164 3/20 0.48
F7 P08709 3/20 0.48
F3 P13726 3/20 0.48
ALDH1A1 P00352 2/20 0.48
ADORA3 P0DMS8 2/20 0.48
PTGS1 P23219 2/20 0.48
RXRA P19793 1/20 0.48
OXER1 Q8TDS5 1/20 0.48
MAPT P10636 3/20 0.47
FABP4 P15090 3/20 0.47
BLM P54132 3/20 0.47
HSD17B10 Q99714 3/20 0.47
USP2 O75604 2/20 0.47
LMNA P02545 2/20 0.47
ALOX15 P16050 2/20 0.47

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
SCHEMBL11745554 0.92 PPARG (0.57) PPARGPPARAPPARDTOP1CYP19A1
SCHEMBL3017777 0.92 PPARG (0.57) PPARGPPARAPPARDTOP1CYP19A1
SCHEMBL28549553 0.92 PPARG (0.57) PPARGPPARAPPARDTOP1CYP19A1
SCHEMBL28645015 0.88 HCAR2 (0.50) PPARGPPARAPPARDTOP1CYP19A1
SCHEMBL10534314 0.88 HCAR2 (0.50) PPARGPPARAPPARDTOP1CYP19A1
SCHEMBL46377 0.88 HCAR2 (0.50) PPARGPPARAPPARDTOP1CYP19A1
SCHEMBL29626505 0.85 HCAR2 (0.57) KMT2AALDH1A1MAPTHSD17B10LMNA
SCHEMBL28401213 0.84 TSHR (0.54) ALDH1A1ADORA3OXER1MAPTLMNA
SCHEMBL12694289 0.84 TSHR (0.54) ALDH1A1ADORA3OXER1MAPTLMNA
SCHEMBL29626440 0.83 HCAR2 (0.55) PPARGPPARAALDH1A1MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9896702-B2 Methods, reagents and cells for biosynthesizing compounds INVISTA NORTH AMERICA S.A.R.L. (US) 2018-02-20 US claimed
EP-3155106-A2 METHODS, REAGENTS AND CELLS FOR BIOSYNTHESIZING COMPOUND Invista Technologies S.à.r.l. (CH) 2017-04-19 EP claimed
WO-2015195611-A2 METHODS, REAGENTS AND CELLS FOR BIOSYNTHESIZING COMPOUND INVISTA TECHNOLOGIES S.À.R.L. (CH) 2015-12-23 WO claimed
US-20150361458-A1 METHODS, REAGENTS AND CELLS FOR BIOSYNTHESIZING COMPOUND INV NYLON CHEMICALS AMERICAS, LLC 2015-12-17 US claimed
US-9896702-B2 Methods, reagents and cells for biosynthesizing compounds INVISTA NORTH AMERICA S.A.R.L. (US) 2018-02-20 US disclosed
EP-3155106-A2 METHODS, REAGENTS AND CELLS FOR BIOSYNTHESIZING COMPOUND Invista Technologies S.à.r.l. (CH) 2017-04-19 EP disclosed
WO-2015195611-A2 METHODS, REAGENTS AND CELLS FOR BIOSYNTHESIZING COMPOUND INVISTA TECHNOLOGIES S.À.R.L. (CH) 2015-12-23 WO disclosed
US-20150361458-A1 METHODS, REAGENTS AND CELLS FOR BIOSYNTHESIZING COMPOUND INV NYLON CHEMICALS AMERICAS, LLC 2015-12-17 US disclosed