SCHEMBL2958798

SCHEMBL2958798

O=C(O)Oc1ccc(OC(=O)O)c2c3ccc(oc(=O)oc(=O)o3)c12

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MGAM O43451 3/20 0.33
CA2 P00918 2/20 0.32
MAOA P21397 1/20 0.31
CA12 O43570 2/20 0.31
CA9 Q16790 2/20 0.31
ADORA3 P0DMS8 1/20 0.31
KDM4E B2RXH2 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
PKM P14618 1/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TTR P02766 1/20 0.30
PIM1 P11309 1/20 0.30
CSNK2A2 P19784 1/20 0.30
CSNK2B P67870 1/20 0.30
CSNK2A1 P68400 1/20 0.30
CSNK2A3 Q8NEV1 1/20 0.30

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
SCHEMBL3006414 0.76 KDM4E (0.35) CA2CA12CA9KDM4EALDH1A1
SCHEMBL856949 0.71 MAOA (0.38) MGAMMAOACA12CA9KDM4E
SCHEMBL8597700 0.69 ADORA3 (0.38) CA2MAOACA12CA9ADORA3
SCHEMBL4446776 0.69 MEN1 (0.41) CA2CA12CA9KDM4EALDH1A1
SCHEMBL297251 0.69 KDM4E (0.31) KDM4EALDH1A1RAB9A
SCHEMBL3644053 0.66 TYMS (0.35)
SCHEMBL6243341 0.66 MAOA (0.49) MAOAKDM4ENPC1ALDH1A1HPGD
SCHEMBL1039198 0.65 MAPK1 (0.36) CA2CA12CA9KDM4EALDH1A1
SCHEMBL11480797 0.65 EDNRA (0.53) KDM4ENPC1RAB9A
SCHEMBL7837897 0.64 ALDH1A1 (0.39) KDM4ENPC1ALDH1A1HPGDRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0193951-B1 PROCESS FOR PRODUCING READILY CRYSTALLIZABLE ARYLENESULFIDE RESIN COMPOSITIONS KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1991-08-07 EP claimed
US-7767753-B2 Binder resin composition, paste and green sheet SEKISUI CHEMICAL CO., LTD. (JP) 2010-08-03 US disclosed
US-20070249770-A1 Binder Resin Composition, Paste and Green Sheet SEKISUI CHEMICAL CO., LTD. (JP) 2007-10-25 US disclosed
EP-1124893-B1 POLYISOCYANATE POLYADDITION PRODUCTS BASF AG (DE) 2004-12-22 EP disclosed
EP-1117718-B1 PROCESS FOR THE PREPARATION OF FOAMED POLYISOCYANATE-POLYADDITION PRODUCTS OR POLYURETHANE ELASTOMERS USING MIXTURES CONTAINING ISOCYANATES AS WELL AS ORGANIC AND/OR INORGANIC ACID ANHYDRIDES BASF AG (DE) 2003-10-01 EP disclosed
EP-1117718-A1 MIXTURE CONTAINING ISOCYANATES AS WELL AS ORGANIC AND/OR INORGANIC ACID ANHYDRIDES BASF AKTIENGESELLSCHAFT (DE) 2001-07-25 EP disclosed
WO-2001000723-A1 POLYISOCYANATE-POLYADDITION PRODUCTS BASF AKTIENGESELLSCHAFT (DE) 2001-01-04 WO disclosed
WO-2000011059-A1 MIXTURE CONTAINING ISOCYANATES AS WELL AS ORGANIC AND/OR INORGANIC ACID ANHYDRIDES BASF AKTIENGESELLSCHAFT (DE) 2000-03-02 WO disclosed
EP-0435379-A2 Suspension, coating, agglomeration and uses of imidoperoxycarboxylic acids Akzo Nobel N.V. (NL) 1991-07-03 EP disclosed
EP-0011078-A1 Process for the manufacture of the pure sodium hydroxide addition compounds of cis-naphthoylene-bis-benzimidazoles HOECHST AKTIENGESELLSCHAFT (DE) 1980-05-28 EP disclosed