SCHEMBL28029522

SCHEMBL28029522

CCCCc1c(C)c(O)c(CCCC)c(CCCC)c1CCC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.42
GPR84 Q9NQS5 7/20 0.41
PPARG P37231 7/20 0.41
PPARD Q03181 7/20 0.41
PPARA Q07869 7/20 0.41
HDAC11 Q96DB2 5/20 0.41
TSHR P16473 4/20 0.41
PTPN1 P18031 3/20 0.41
ALDH1A1 P00352 2/20 0.41
TLR2 O60603 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
FABP4 P15090 2/20 0.41
FFAR1 O14842 2/20 0.41
SLC22A6 Q4U2R8 1/20 0.41
SLC22A8 Q8TCC7 1/20 0.41
MEN1 O00255 1/20 0.41
ESR1 P03372 1/20 0.41
ALOX15 P16050 1/20 0.41
PDE4A P27815 1/20 0.41
KMT2A Q03164 1/20 0.41

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
Tetrabutyhydroxytoluene SCHEMBL2899487 0.84 HPGD (0.45) ALDH1A1FFAR1HSD17B10
SCHEMBL28454033 0.78 HPGD (0.43) ALDH1A1FFAR1HSD17B10
SCHEMBL27797480 0.78 HPGD (0.43) ALDH1A1FFAR1HSD17B10
SCHEMBL27929167 0.75 HPGD (0.41) ALDH1A1FFAR1HSD17B10
SCHEMBL27993622 0.74 HPGD (0.43) ALDH1A1FFAR1HSD17B10
SCHEMBL268313 0.73 HPGD (0.50) ALDH1A1FFAR1HSD17B10
SCHEMBL5586620 0.73 HPGD (0.50) ALDH1A1FFAR1ESR1HSD17B10
SCHEMBL9848754 0.73 HDAC11 (0.41) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL5587370 0.73 LDHA (0.49) PPARGPPARAFFAR1APP
SCHEMBL1403738 0.72 SCD (0.45) GPR84PPARGPPARDPPARAHDAC11

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
CN-103709442-B Stabilizer and composition comprising the same Double bond chemical (Shanghai) Co.,Ltd. (CN) 2016-01-06 CN disclosed
CN-103601916-B stabilizer and composition comprising the same Double bond chemical (Shanghai) Co.,Ltd. (CN) 2015-10-14 CN disclosed