SCHEMBL6863260

SCHEMBL6863260

C=Cc1cccc2ccccc12.C=Cc1ccccc1C=C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.50
SIRT1 Q96EB6 1/20 0.50
RXRA P19793 1/20 0.47
ALDH1A1 P00352 4/20 0.46
TSHR P16473 3/20 0.46
HSD17B10 Q99714 3/20 0.46
CYP2A6 P11509 3/20 0.46
GRIN2D O15399 2/20 0.46
GRIN3B O60391 2/20 0.46
GRIN1 Q05586 2/20 0.46
GRIN2A Q12879 2/20 0.46
GRIN2B Q13224 2/20 0.46
GRIN2C Q14957 2/20 0.46
GRIN3A Q8TCU5 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
ACHE P22303 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
CHAT P28329 2/20 0.44
HDAC8 Q9BY41 1/20 0.44

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
SCHEMBL14912 1.00 SIRT2 (0.50) SIRT2SIRT1RXRAALDH1A1TSHR
SCHEMBL29357296 1.00 SIRT2 (0.50) SIRT2SIRT1RXRAALDH1A1TSHR
SCHEMBL31610342 1.00 SIRT2 (0.50) SIRT2SIRT1RXRAALDH1A1TSHR
SCHEMBL18139227 0.98 SIRT2 (0.49) SIRT2SIRT1RXRAALDH1A1TSHR
SCHEMBL30925393 0.98 SIRT2 (0.49) SIRT2SIRT1RXRAALDH1A1TSHR
SCHEMBL18139134 0.98 SIRT2 (0.49) SIRT2SIRT1RXRAALDH1A1TSHR
Potassium SCHEMBL18141101 0.98 SIRT2 (0.49) SIRT2SIRT1RXRAALDH1A1TSHR
Ammonia Solution, Strong SCHEMBL1824430 0.98 SIRT2 (0.49) SIRT2SIRT1RXRAALDH1A1TSHR
SCHEMBL18141098 0.98 SIRT2 (0.49) SIRT2SIRT1RXRAALDH1A1TSHR
SCHEMBL18139131 0.98 SIRT2 (0.49) SIRT2SIRT1RXRAALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1123264-B1 PROCESS FOR THE MANUFACTURE OF ALPHA,ALPHA-BRANCHED CARBOXYLIC ACIDS RESOLUTION RES NEDERLAND BV (NL) 2004-07-28 EP claimed
EP-1115684-B1 PROCESS FOR THE MANUFACTURE OF QUATERNARY CARBOXYLIC ACIDS RESOLUTION RES NEDERLAND BV (NL) 2002-12-18 EP claimed
EP-1123264-A1 PROCESS FOR THE MANUFACTURE OF $g(a),$g(a)-BRANCHED CARBOXYLIC ACIDS Resolution Research Nederland B.V. (NL) 2001-08-16 EP claimed
EP-1115684-A1 PROCESS FOR THE MANUFACTURE OF QUATERNARY CARBOXYLIC ACIDS Resolution Research Nederland B.V. (NL) 2001-07-18 EP claimed
US-6211406-B1 REACTING LINEAR OLEFINS WITH CARBON MONOXIDE AND WATER IN PRESENCE OF ACID CATALYST AND POLAR NON-COORDINATING ORGANIC SOLVENT TO PRODUCE QUATERNARY CARBOXYLIC ACIDS SHELL OIL COMPANY 2001-04-03 US claimed
WO-2000024700-A1 PROCESS FOR THE MANUFACTURE OF α,α-BRANCHED CARBOXYLIC ACIDS RESOLUTION RESEARCH NEDERLAND B.V. (NL) 2000-05-04 WO claimed
WO-2000017146-A1 PROCESS FOR THE MANUFACTURE OF QUATERNARY CARBOXYLIC ACIDS RESOLUTION RESEARCH NEDERLAND B.V. (NL) 2000-03-30 WO claimed
US-20240166785-A1 CATECHOL CONTAINING POLYMER EMULSIONS AND METHODS OF PREPARATION THEREOF THE UNIVERSITY OF AKRON 2024-05-23 US disclosed
EP-1123264-B1 PROCESS FOR THE MANUFACTURE OF ALPHA,ALPHA-BRANCHED CARBOXYLIC ACIDS RESOLUTION RES NEDERLAND BV (NL) 2004-07-28 EP disclosed
EP-1115684-B1 PROCESS FOR THE MANUFACTURE OF QUATERNARY CARBOXYLIC ACIDS RESOLUTION RES NEDERLAND BV (NL) 2002-12-18 EP disclosed
EP-1123264-A1 PROCESS FOR THE MANUFACTURE OF $g(a),$g(a)-BRANCHED CARBOXYLIC ACIDS Resolution Research Nederland B.V. (NL) 2001-08-16 EP disclosed
EP-1115684-A1 PROCESS FOR THE MANUFACTURE OF QUATERNARY CARBOXYLIC ACIDS Resolution Research Nederland B.V. (NL) 2001-07-18 EP disclosed
US-6211406-B1 REACTING LINEAR OLEFINS WITH CARBON MONOXIDE AND WATER IN PRESENCE OF ACID CATALYST AND POLAR NON-COORDINATING ORGANIC SOLVENT TO PRODUCE QUATERNARY CARBOXYLIC ACIDS SHELL OIL COMPANY 2001-04-03 US disclosed
WO-2000024700-A1 PROCESS FOR THE MANUFACTURE OF α,α-BRANCHED CARBOXYLIC ACIDS RESOLUTION RESEARCH NEDERLAND B.V. (NL) 2000-05-04 WO disclosed
WO-2000017146-A1 PROCESS FOR THE MANUFACTURE OF QUATERNARY CARBOXYLIC ACIDS RESOLUTION RESEARCH NEDERLAND B.V. (NL) 2000-03-30 WO disclosed
US-4554232-A EPOXY RESIN CROSSLINKED WITH AMINOSILANE HITACHI METALS, LTD. (JP) 1985-11-19 US disclosed