SCHEMBL3709017

SCHEMBL3709017

CCCCCCCCCCCCc1ccc(C(C)(C)C)c(O)c1C(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.49
ALOX5 P09917 5/20 0.46
TP53 P04637 2/20 0.46
CYP3A4 P08684 2/20 0.46
MEN1 O00255 1/20 0.46
MAPT P10636 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
LIPG Q9Y5X9 1/20 0.40
PTGS2 P35354 5/20 0.40
ESR1 P03372 2/20 0.40
ADRA2A P08913 2/20 0.40
ADORA3 P0DMS8 2/20 0.40
TACR2 P21452 2/20 0.40
SLC6A2 P23975 2/20 0.40
SLC6A4 P31645 2/20 0.40
SLC6A3 Q01959 2/20 0.40

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
SCHEMBL30816147 1.00 TYR (0.49) TYRALOX5TP53CYP3A4MEN1
SCHEMBL29170685 1.00 TYR (0.49) TYRALOX5TP53CYP3A4MEN1
SCHEMBL6897662 1.00 TYR (0.49) TYRALOX5TP53CYP3A4MEN1
SCHEMBL28307750 1.00 TYR (0.49) TYRALOX5TP53CYP3A4MEN1
SCHEMBL1846556 1.00 TYR (0.49) TYRALOX5TP53CYP3A4MEN1
SCHEMBL35794 0.93 TYR (0.43) TYRALOX5TP53CYP3A4MEN1
SCHEMBL29068772 0.92 F7 (0.45) TYRALOX5TP53CYP3A4MEN1
SCHEMBL29068766 0.89 TYR (0.40) TYRALOX5TP53CYP3A4MEN1
SCHEMBL29766715 0.86 CA2 (0.42) TYRTSHRKMT2ATDP1PTGS2
SCHEMBL10904233 0.86 CA2 (0.42) TYRTSHRKMT2ATDP1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8293689-B2 Lubricating composition containing a polymer and antiwear agents THE LUBRIZOL CORPORATION (US) 2012-10-23 US disclosed
EP-2398875-A1 COMPOSITION CONTAINING ESTER COMPOUNDS AND A METHOD OF LUBRICATING AN INTERNAL COMBUSTION ENGINE The Lubrizol Corporation (US) 2011-12-28 EP disclosed
WO-2010096286-A1 COMPOSITION CONTAINING ESTER COMPOUNDS AND A METHOD OF LUBRICATING AN INTERNAL COMBUSTION ENGINE THE LUBRIZOL CORPORATION (US) 2010-08-26 WO disclosed
US-20090312210-A1 Lubricating Composition Containing a Polymer and Antiwear Agents THE LUBRIZOL CORPORATION (US) 2009-12-17 US disclosed
EP-2029707-A2 LUBRICATING COMPOSITION CONTAINING A POLYMER AND ANTIWEAR AGENTS The Lubrizol Corporation (US) 2009-03-04 EP disclosed
WO-2007133995-A2 LUBRICATING COMPOSITION CONTAINING A POLYMER AND ANTIWEAR AGENTS THE LUBRIZOL CORPORATION (US) 2007-11-22 WO disclosed
US-6596672-B1 A calcium, barium, or strontium overbased acidic material in an amount to contribute 0.01 to 0.79 percent sulfated ash; a magnesium or sodium overbased acidic material in an amount to contribute 0.01 to 0.79 percent sulfated ash THE LUBRIZOL CORPORATION 2003-07-22 US disclosed
EP-0725129-B1 Low ash lubricant compositions LUBRIZOL CORP (US) 2001-12-12 EP disclosed
EP-0725129-A2 Low ash lubricant compositions The Lubrizol Corporation (US) 1996-08-07 EP disclosed