SCHEMBL6849064

SCHEMBL6849064

N#CC(O)CCCCCCCCCCCCCCCCO

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.32
ALDH1A1 P00352 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TSHR P16473 1/20 0.32
MIF P14174 1/20 0.30

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
SCHEMBL31540579 0.97
SCHEMBL28073293 0.90
SCHEMBL13937394 0.81
SCHEMBL7906033 0.80 TSHR (0.37) ALDH1A1TSHR
SCHEMBL6520969 0.79 LMNA (0.35) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL1291215 0.78
SCHEMBL8845886 0.78 GPR84 (0.45) LMNA
SCHEMBL5353579 0.78 GPR84 (0.45) LMNA
SCHEMBL5353586 0.78 GPR84 (0.45) LMNA
SCHEMBL686971 0.78 GPR84 (0.45) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6770679-B1 NONIONIC SURFACTANTS; HARD SURFACES; VEHICLE AND BOTTLE CLEANING, MACHINE DISHWASHING OR MACHINE WASHING OF TEXTILES AKZO NOBEL N.V (NL) 2004-08-03 US disclosed
EP-1196376-B1 COMPOUNDS FROM EPOXIDISED NITRILES, PROCESS FOR THEIR PRODUCTION AND USE AS CLEANING AGENTS AKZO NOBEL NV (NL) 2003-08-20 EP disclosed
EP-1196376-A1 COMPOUNDS FROM EPOXIDISED NITRILES, PROCESS FOR THEIR PRODUCTION AND USE AS CLEANING AGENTS AKZO NOBEL N.V. (NL) 2002-04-17 EP disclosed
WO-2001000567-A1 COMPOUNDS FROM EPOXIDISED NITRILES, PROCESS FOR THEIR PRODUCTION AND USE AS CLEANING AGENTS AKZO NOBEL NV (NL) 2001-01-04 WO disclosed