SCHEMBL3675571

SCHEMBL3675571

CCCCCCCCCCCCCCCCC(OC)C(=O)CC(=O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 2/20 0.46
CTSG P08311 2/20 0.46
CTRB1 P17538 2/20 0.46
CMA1 P23946 2/20 0.46
NAAA Q02083 1/20 0.46
HDAC2 Q92769 2/20 0.44
CES1 P23141 3/20 0.43
KMT2A Q03164 3/20 0.43
CES2 O00748 2/20 0.43
MEN1 O00255 2/20 0.43
CYP3A4 P08684 2/20 0.43
HPGD P15428 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
ALOX15 P16050 1/20 0.43
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ALDH1A1 P00352 2/20 0.42
HAO1 Q9UJM8 1/20 0.42

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
SCHEMBL11178982 0.82 KMT2A (0.49) PRSS1CTSGCTRB1CMA1NAAA
SCHEMBL7053072 0.81 MEN1 (0.48) PRSS1CTSGCTRB1CMA1NAAA
SCHEMBL4892494 0.81 NAAA (0.49) PRSS1CTSGCTRB1CMA1NAAA
SCHEMBL5271812 0.81 NAAA (0.49) PRSS1CTSGCTRB1CMA1NAAA
SCHEMBL7526711 0.77 KMT2A (0.52) PRSS1CTSGCTRB1CMA1CES1
SCHEMBL151369 0.76 PRSS1 (0.48) PRSS1CTSGCTRB1CMA1NAAA
SCHEMBL27818970 0.75 KMT2A (0.51) PRSS1CTSGCTRB1CMA1CES1
SCHEMBL28230541 0.75 CES1 (0.50) PRSS1CTSGCTRB1CMA1NAAA
SCHEMBL22462360 0.75 MMP2 (0.44) PRSS1CTSGCTRB1CMA1NAAA
SCHEMBL11389509 0.75 KMT2A (0.57) PRSS1CTSGCTRB1CMA1NAAA

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1349823-B1 PROCESS FOR BASE-PROMOTED CONDENSATION REACTIONS AND BASE REAGENT THEREFOR CHEMTURA CORP (US) 2007-11-21 EP claimed
EP-1349823-A1 PROCESS FOR BASE-PROMOTED CONDENSATION REACTIONS AND BASE REAGENT THEREFOR Crompton Corporation (US) 2003-10-08 EP claimed
WO-2002055466-A1 PROCESS FOR BASE-PROMOTED CONDENSATION REACTIONS AND BASE REAGENT THEREFOR CROMPTON CORPORATION (US) 2002-07-18 WO claimed
US-6410795-B1 FORMING DIKETONES CROMPTON CORPORATION 2002-06-25 US claimed
EP-1877481-B1 STABILISER COMPOSITION FOR HALIDE-CONTAINING POLYMERS SUN ACE KAKOH PTE LTD (SG) 2016-02-17 EP disclosed
EP-2697300-A1 HYDROQUINONE COMPOUNDS FOR REDUCING PHOTOBLUEING OF HALOGEN-CONTAINING POLYMERS Chemson Polymer-Additive AG (AT) 2014-02-19 EP disclosed
EP-2688952-A1 STABILIZER COMPOSITION FOR HALOGEN-CONTAINING POLYMERS Chemson Polymer-Additive AG (AT) 2014-01-29 EP disclosed
WO-2012140054-A1 HYDROQUINONE COMPOUNDS FOR REDUCING PHOTOBLUEING OF HALOGEN-CONTAINING POLYMERS CHEMSON POLYMER-ADDITIVE AG (AT) 2012-10-18 WO disclosed
WO-2012126948-A1 STABILIZER COMPOSITION FOR HALOGEN-CONTAINING POLYMERS CHEMSON POLYMER-ADDITIVE AG (AT) 2012-09-27 WO disclosed
US-7842743-B2 Stabiliser composition for halide-containing polymers SUN ACE KAKOH (PTE.) LTD. (SG) 2010-11-30 US disclosed
US-20090030123-A1 STABILISER COMPOSITION FOR HALIDE-CONTAINING POLYMERS SUN ACE KAKOH (PTE.) LTD. (SG) 2009-01-29 US disclosed
EP-1877481-A2 STABILISER COMPOSITION FOR HALIDE-CONTAINING POLYMERS Sun Ace Kakoh (Pte.) Ltd. (SG) 2008-01-16 EP disclosed
WO-2006110112-A2 STABILISER COMPOSITION FOR HALIDE-CONTAINING POLYMERS SUN ACE KAKOH (PTE.) LTD. (SG) 2006-10-19 WO disclosed
WO-2006110106-A1 STABILISER COMPOSITION FOR CHLORINE-CONTAINING POLYMERS SUN ACE KAKOK (PTE.) LTD. (SG) 2006-10-19 WO disclosed
EP-1349823-A1 PROCESS FOR BASE-PROMOTED CONDENSATION REACTIONS AND BASE REAGENT THEREFOR Crompton Corporation (US) 2003-10-08 EP disclosed
WO-2002055466-A1 PROCESS FOR BASE-PROMOTED CONDENSATION REACTIONS AND BASE REAGENT THEREFOR CROMPTON CORPORATION (US) 2002-07-18 WO disclosed
US-6410795-B1 FORMING DIKETONES CROMPTON CORPORATION 2002-06-25 US disclosed
EP-0507013-B1 Process for the preparation of aromatic beta-diketones WITCO CORP (US) 1996-02-07 EP disclosed
EP-0507013-A1 Process for the preparation of aromatic beta-diketones WITCO CORPORATION (US) 1992-10-07 EP disclosed
US-5015777-A Reaction of an acetophenone and an aliphatic ester or an ester of benzoic acid in the presence of sodium alkoxide condensation agent in an aromatic solvent WITCO CORPORATION (US) 1991-05-14 US disclosed