SCHEMBL4776902

SCHEMBL4776902

CCCOOC(=O)OOCCC.[MgH2]

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.35
HCAR2 Q8TDS4 1/20 0.33
SOAT1 P35610 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
LMNA P02545 1/20 0.31
ATM Q13315 1/20 0.31
CES2 O00748 1/20 0.30
CES1 P23141 1/20 0.30
ESR1 P03372 1/20 0.30
CHRM1 P11229 1/20 0.30
TSHR P16473 1/20 0.30
SLC6A2 P23975 1/20 0.30
KDR P35968 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
NAAA Q02083 1/20 0.30
DGKA P23743 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
SCHEMBL5560623 0.97 ALDH1A1 (0.36) ALDH1A1HCAR2SOAT1LMNAATM
SCHEMBL4757130 0.86 SOAT1 (0.42) ALDH1A1HCAR2SOAT1LMNAATM
SCHEMBL27524303 0.84
SCHEMBL193251 0.84 HCAR2 (0.40) ALDH1A1HCAR2SOAT1LMNAATM
SCHEMBL27787614 0.82 ALDH1A1 (0.55) ALDH1A1HCAR2SOAT1LMNAATM
SCHEMBL3155224 0.81 ALDH1A1 (0.48) ALDH1A1HCAR2L3MBTL1ATMCES2
SCHEMBL14696405 0.81 ALDH1A1 (0.33) ALDH1A1HCAR2SOAT1LMNAATM
SCHEMBL4757133 0.80 FFAR3 (0.33) ALDH1A1HCAR2SOAT1LMNANAAA
SCHEMBL14719802 0.79 NAAA (0.46) ALDH1A1HCAR2CES2CES1TSHR
SCHEMBL25285653 0.79 HDAC6 (0.33)

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
US-20080017336-A1 Process For Preservation Of Cellulosic Materials CONSERVACLON DE SUSTRATOS CELULOSLCOS S.L. (ES) 2008-01-24 US disclosed
EP-1759061-A1 PROCESS FOR PRESERVATION OF CELLULOSIC MATERIALS CONSERVACION DE SUSTRATOS CELULOSICOS S.L. (ES) 2007-03-07 EP disclosed
WO-2005083176-A1 PROCESS FOR PRESERVATION OF CELLULOSIC MATERIALS CONSERVACION DE SUSTRATOS CELULOSICOS S.L. (ES) 2005-09-09 WO disclosed