SCHEMBL2334824

SCHEMBL2334824

COc1cc(C=CC(=O)c2cccc3c2S(=O)(=O)NC3=O)ccc1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.60
PTGS2 P35354 1/20 0.60
CXCL12 P48061 7/20 0.58
AR P10275 2/20 0.55
CHRNA7 P36544 1/20 0.55
NFKB1 P19838 2/20 0.54
NFKB2 Q00653 2/20 0.54
RELA Q04206 2/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
MAOB P27338 2/20 0.52
ACHE P22303 1/20 0.52
ABCG2 Q9UNQ0 1/20 0.52
MAOA P21397 1/20 0.52
CYP1A2 P05177 1/20 0.50
ALOX5 P09917 1/20 0.50
CYP2D6 P10635 1/20 0.50
HSD11B1 P28845 1/20 0.50
STAT3 P40763 1/20 0.50

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
SCHEMBL362202 0.81 CYP3A4 (0.51) ARCHRNA7NFKB1NFKB2RELA
Ferulate SCHEMBL27703868 0.79 KDM4E (0.64) PTGS1PTGS2CXCL12NFKB1NFKB2
SCHEMBL29427953 0.76 PTGS1 (1.00) PTGS1PTGS2CXCL12ARCHRNA7
SCHEMBL3396596 0.76 PTGS1 (1.00) PTGS1PTGS2CXCL12ARCHRNA7
SCHEMBL3396591 0.76 PTGS1 (1.00) PTGS1PTGS2CXCL12ARCHRNA7
SCHEMBL25195740 0.76 PTGS1 (1.00) PTGS1PTGS2CXCL12ARCHRNA7
SCHEMBL25191295 0.76 PTGS1 (0.85) PTGS1PTGS2CXCL12ARCHRNA7
SCHEMBL22411695 0.76 PTGS1 (0.79) PTGS1PTGS2CXCL12ARCHRNA7
SCHEMBL25195162 0.74 PTGS1 (0.81) PTGS1PTGS2CXCL12ARCHRNA7
SCHEMBL25199726 0.73 PTGS1 (0.79) PTGS1PTGS2CXCL12ARCHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4320252-A1 ENZYME COMPOSITION DSM IP Assets B.V. (NL) 2024-02-14 EP disclosed
EP-4320258-A1 ENZYME COMPOSITION DSM IP Assets B.V. (NL) 2024-02-14 EP disclosed
EP-4320257-A1 ENZYME COMPOSITION DSM IP Assets B.V. (NL) 2024-02-14 EP disclosed
EP-4320259-A1 PROCESS FOR THE PREPARATION OF A SUGAR PRODUCT AND A FERMENTATION PRODUCT Versalis S.p.A. (IT) 2024-02-14 EP disclosed
EP-3695001-B1 PROCESS FOR ENZYMATIC HYDROLYSIS OF LIGNOCELLULOSIC MATERIAL AND FERMENTATION OF SUGARS VERSALIS SPA (IT) 2024-01-10 EP disclosed
EP-3613860-B1 PROCESS FOR ENZYMATIC HYDROLYSIS OF LIGNOCELLULOSIC MATERIAL AND FERMENTATION OF SUGARS VERSALIS SPA (IT) 2023-12-27 EP disclosed
EP-3137619-B1 PROCESS FOR ENZYMATIC HYDROLYSIS OF LIGNOCELLULOSIC MATERIAL AND FERMENTATION OF SUGARS VERSALIS SPA (IT) 2023-12-27 EP disclosed
WO-2023164436-A1 PROCESS FOR PRODUCING FERMENTATION PRODUCTS AND BIOGAS FROM STARCH-CONTAINING MATERIALS NOVOZYMES A/S (DK) 2023-08-31 WO disclosed
WO-2023159251-A1 METHOD FOR CARRING OUT THE COMBINED OPERATION OF A BIOETHANOL PRODUCTION UNIT AND A BIOGAS UNIT NOVOZYMES A/S (DK) 2023-08-24 WO disclosed
EP-3802843-B1 PROCESS FOR PRODUCING SUGARS FROM CARBOHYDRATE MATERIALS VERSALIS SPA (IT) 2023-03-29 EP disclosed
WO-2012000890-A1 POLYPEPTIDE HAVING BETA-GLUCOSIDASE ACTIVITY AND USES THEREOF DSM IP ASSETS B.V. (NL) 2012-01-05 WO disclosed
WO-2011098577-A1 HOST CELL CAPABLE OF PRODUCING ENZYMES USEFUL FOR DEGRADATION OF LIGNOCELLULOSIC MATERIAL DSM IP ASSETS B.V. (NL) 2011-08-18 WO disclosed
WO-2010122141-A1 CARBOHYDRATE DEGRADING POLYPEPTIDE AND USES THEREOF DSM IP ASSETS B.V. (NL) 2010-10-28 WO disclosed
WO-2010018105-A1 DEGRADATION OF LIGNOCELLULOSIC MATERIAL DSM IP ASSETS B.V. (NL) 2010-02-18 WO disclosed
WO-2009133039-A1 CARBOHYDRATE MODIFYING POLYPEPTIDE AND USES THEREOF DSM IP ASSETS B.V. (NL) 2009-11-05 WO disclosed
WO-2009133038-A1 CARBOHYDRATE MODIFYING POLYPEPTIDE AND USES THEREOF DSM IP ASSETS B.V. (NL) 2009-11-05 WO disclosed
WO-2009133035-A1 CELLOBIOHYDROLASE 1 FROM PENICILLIUM CHYSOGENUM AND USES THEREOF DSM IP ASSETS B.V. (NL) 2009-11-05 WO disclosed
WO-2009133036-A1 CELLOBIOHYDROLASE 1 FROM PENICILLIUM CHYSOGENUM AND USES THEREOF DSM IP ASSETS B.V. (NL) 2009-11-05 WO disclosed
WO-2009133037-A1 CARBOHYDRATE MODIFYING POLYPEPTIDE AND USES THEREOF DSM IP ASSETS B.V. (NL) 2009-11-05 WO disclosed
WO-2009133034-A1 CARBOHYDRATE MODIFYING POLYPEPTIDE AND USES THEREOF DSM IP ASSETS B.V. (NL) 2009-11-05 WO disclosed