SCHEMBL7571565

SCHEMBL7571565

CCCCCCc1ccc(CCCCCC)c(CCCCCC)c1CCCCCC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 3/20 0.57
TP53 P04637 2/20 0.53
CYP3A4 P08684 2/20 0.53
MEN1 O00255 1/20 0.53
ALOX5 P09917 1/20 0.53
MAPT P10636 1/20 0.53
ALOX15 P16050 1/20 0.53
TSHR P16473 1/20 0.53
HTT P42858 1/20 0.53
KMT2A Q03164 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
LIPG Q9Y5X9 1/20 0.50
ESR1 P03372 2/20 0.45
ADRA2A P08913 2/20 0.45
ADORA3 P0DMS8 2/20 0.45
TACR2 P21452 2/20 0.45
SLC6A2 P23975 2/20 0.45
SLC6A4 P31645 2/20 0.45
SLC6A3 Q01959 2/20 0.45
KCNH2 Q12809 2/20 0.45

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
SCHEMBL11337178 1.00 TYR (0.57) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL11340537 1.00 TYR (0.57) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL11323286 1.00 TYR (0.57) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL1822032 1.00 TYR (0.57) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL11331495 1.00 TYR (0.57) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL30876168 1.00 TYR (0.57) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL11328017 1.00 TYR (0.57) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL10608218 1.00 TYR (0.57) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL31230428 0.97 TYR (0.53) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL1133572 0.97 TYR (0.53) TYRTP53CYP3A4MEN1ALOX5

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
CN-104955919-A Amide branched aromatic gellant enhancers and breakers SYNOIL FLUIDS HOLDINGS INC 2015-09-30 CN disclosed
WO-2002052256-A1 AN IMPROVED METHOD FOR QUANTITATIVE ASSESSMENT OF ANTHROPOGENIC COMPOUNDS IN SOIL A/S ANALYCEN (DK) 2002-07-04 WO disclosed
EP-1217371-A1 An improved method for quantitative assessment of anthropogenic compounds in soil A/S AnalyCen (DK) 2002-06-26 EP disclosed
EP-0307000-B1 METHOD FOR THE PREPARATION OF 1,3-OXATHIOLANES TORAY SILICONE COMPANY, LIMITED (JP) 1991-06-19 EP disclosed