SCHEMBL7565833

SCHEMBL7565833

C=C(C=O)CCCCCCCCCCCCCCC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.48
CES1 P23141 4/20 0.48
GPR84 Q9NQS5 7/20 0.46
PPARG P37231 7/20 0.46
PPARD Q03181 7/20 0.46
PPARA Q07869 7/20 0.46
HDAC11 Q96DB2 5/20 0.46
TSHR P16473 5/20 0.46
PTPN1 P18031 3/20 0.46
ALDH1A1 P00352 3/20 0.46
TLR2 O60603 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
FABP4 P15090 2/20 0.46
SLC22A6 Q4U2R8 1/20 0.46
SLC22A8 Q8TCC7 1/20 0.46
MEN1 O00255 1/20 0.46
ESR1 P03372 1/20 0.46
ALOX15 P16050 1/20 0.46
PDE4A P27815 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL9445758 1.00 CES2 (0.48) CES2CES1GPR84PPARGPPARD
SCHEMBL3192768 1.00 CES2 (0.48) CES2CES1GPR84PPARGPPARD
SCHEMBL10708297 1.00 CES2 (0.48) CES2CES1GPR84PPARGPPARD
SCHEMBL182420 1.00 CES2 (0.48) CES2CES1GPR84PPARGPPARD
SCHEMBL3206128 1.00 CES2 (0.48) CES2CES1GPR84PPARGPPARD
SCHEMBL3203104 1.00 CES2 (0.48) CES2CES1GPR84PPARGPPARD
SCHEMBL5694624 1.00 CES2 (0.48) CES2CES1GPR84PPARGPPARD
SCHEMBL1135913 0.98
SCHEMBL182307 0.90
Hexanal SCHEMBL23925721 0.83 TSHR (0.58) PPARGPPARDPPARATSHRPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102093166-B Method for synthesizing marine natural product by using high optical activity enantiomer UNIV CHINA AGRICULTURAL 2014-04-09 CN claimed
CN-102093166-A Method for synthesizing marine natural product by using high optical activity enantiomer UNIV CHINA AGRICULTURAL 2011-06-15 CN claimed
CN-102093166-B Method for synthesizing marine natural product by using high optical activity enantiomer UNIV CHINA AGRICULTURAL 2014-04-09 CN disclosed
CN-102093166-A Method for synthesizing marine natural product by using high optical activity enantiomer UNIV CHINA AGRICULTURAL 2011-06-15 CN disclosed
CN-1123558-C Method for preparing polyalohols BASF AG (DE) 2003-10-08 CN disclosed
EP-0946483-B1 METHOD FOR PRODUCING POLYALCOHOLS BASF AG (DE) 2002-09-04 EP disclosed
US-6187971-B1 MULTISTAGE REACTION OF ALDEHYDE WITH FORMALDEHYDE, DISTILLATION AND CATALYTIC REACTION TO CONVERT THE ALDEHYDE TO UNSATURATED COMPOUND BASF AKTIENGESELLSCHAFT (DE) 2001-02-13 US disclosed
CN-1238753-A Method for preparing polyalohols BASF AG (DE) 1999-12-15 CN disclosed
EP-0946483-A1 METHOD FOR PRODUCING POLYALCOHOLS BASF AKTIENGESELLSCHAFT (DE) 1999-10-06 EP disclosed
WO-1998028253-A1 METHOD FOR PRODUCING POLYALCOHOLS BASF AKTIENGESELLSCHAFT (DE) 1998-07-02 WO disclosed