SCHEMBL4453452

SCHEMBL4453452

CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
F7 P08709 3/20 0.48
F3 P13726 3/20 0.48
CYP19A1 P11511 3/20 0.48
MAPT P10636 2/20 0.48
OXER1 Q8TDS5 2/20 0.48
PTGS1 P23219 2/20 0.48
PPARG P37231 2/20 0.48
KMT2A Q03164 2/20 0.48
PPARD Q03181 2/20 0.48
PPARA Q07869 2/20 0.48
CYP3A4 P08684 2/20 0.48
ALOX15 P16050 2/20 0.48
HSD17B10 Q99714 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
NR1I2 O75469 2/20 0.48
PTGS2 P35354 2/20 0.48
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.48
FFAR1 O14842 1/20 0.48

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
SCHEMBL19293202 1.00 ALDH1A1 (0.48) ALDH1A1F7F3CYP19A1MAPT
SCHEMBL26183267 0.98 ALDH1A1 (0.52) ALDH1A1F7F3CYP19A1MAPT
SCHEMBL2007297 0.93 LMNA (0.42) ALDH1A1F7F3CYP19A1MAPT
SCHEMBL2007296 0.93 LMNA (0.42) ALDH1A1F7F3CYP19A1MAPT
SCHEMBL2006760 0.91 HIF1A (0.42) ALDH1A1F7F3CYP19A1MAPT
SCHEMBL9210912 0.91 HIF1A (0.42) ALDH1A1F7F3CYP19A1MAPT
SCHEMBL2006762 0.91 HIF1A (0.42) ALDH1A1F7F3CYP19A1MAPT
SCHEMBL23229756 0.86 ALDH1A1 (0.39) ALDH1A1F7F3CYP19A1MAPT
SCHEMBL2005707 0.86 ALDH1A1 (0.39) ALDH1A1F7F3CYP19A1MAPT
SCHEMBL2005706 0.86 ALDH1A1 (0.39) ALDH1A1F7F3CYP19A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2129646-A2 OMEGA-3 LIPID COMPOUNDS Pronova Biopharma Norge AS (NO) 2009-12-09 EP disclosed
WO-2008132552-A2 OMEGA-3 LIPID COMPOUNDS PRONOVA BIOPHARMA NORGE AS (US) 2008-11-06 WO disclosed