SCHEMBL4737590

SCHEMBL4737590

O=CCCCCC(=O)OO

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
TSHR P16473 4/20 0.37
MAPT P10636 2/20 0.34
KMT2A Q03164 1/20 0.34
CYP3A4 P08684 1/20 0.34
ALOX15 P16050 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
DGKA P23743 1/20 0.34
FAAH O00519 2/20 0.33
TRPV1 Q8NER1 1/20 0.33
PRKCE Q02156 1/20 0.33
PRKCQ Q04759 1/20 0.33
PRKCD Q05655 1/20 0.33
PRKCA P17252 1/20 0.33
ABCC4 O15439 1/20 0.32
CNR2 P34972 1/20 0.32
EPHX2 P34913 1/20 0.32

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
SCHEMBL10989127 0.98 ALDH1A1 (0.44) HIF1AALDH1A1LMNATSHRMAPT
SCHEMBL8750702 0.93
SCHEMBL5032027 0.88 ALDH1A1 (0.42) HIF1AALDH1A1LMNATSHRCYP3A4
SCHEMBL23754668 0.83 HIF1A (0.43) HIF1AALDH1A1LMNATSHRMAPT
SCHEMBL29091096 0.83 HIF1A (0.43) HIF1AALDH1A1LMNATSHRMAPT
SCHEMBL626319 0.82
SCHEMBL133484 0.82 TSHR (0.45) ALDH1A1LMNATSHRMAPTDGKA
SCHEMBL27918855 0.81 ALDH1A1 (0.45) HIF1AALDH1A1LMNATSHRMAPT
SCHEMBL3625646 0.81 ALDH1A1 (0.45) HIF1AALDH1A1LMNATSHRMAPT
SCHEMBL272758 0.79 LMNA (0.64) HIF1AALDH1A1LMNATSHRKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008079855-A2 ENHANCED OIL RECOVERY SYSTEMS AND CONSUMER PRODUCTS CONTAINING SECONDARY ALCOHOL DERIVATIVES SHELL OIL COMPANY (US) 2008-07-03 WO disclosed
EP-1175483-A1 DETERGENT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2002-01-30 EP disclosed
WO-2000066694-A1 DETERGENT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2000-11-09 WO disclosed
EP-0883671-A1 LAUNDRY DETERGENT COMPOSITIONS CONTAINING SILICONE EMULSIONS THE PROCTER & GAMBLE COMPANY (US) 1998-12-16 EP disclosed
WO-1997031997-A1 LAUNDRY DETERGENT COMPOSITIONS CONTAINING SILICONE EMULSIONS THE PROCTER & GAMBLE COMPANY (US) 1997-09-04 WO disclosed
WO-1996012782-A1 LOW SUDSING LIQUID DETERGENT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1996-05-02 WO disclosed