SCHEMBL1728306

SCHEMBL1728306

O=C(O)Oc1cccc(OC(=O)O)c1OC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.47
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
HSD17B10 Q99714 6/20 0.39
KDM4E B2RXH2 6/20 0.39
HPGD P15428 6/20 0.39
ALDH1A1 P00352 5/20 0.38
MAPT P10636 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
KMT2A Q03164 2/20 0.38
ESR1 P03372 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
ITGB3 P05106 1/20 0.38
ITGA2B P08514 1/20 0.38
HMGB1 P09429 1/20 0.38
TSHR P16473 1/20 0.38

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
Water SCHEMBL2704404 0.98 MAPK1 (0.46) MAPK1CA12CA1CA2CA7
SCHEMBL9419489 0.93 MAPK1 (0.43) MAPK1CA12CA1CA2CA7
SCHEMBL686294 0.89 MAPK1 (0.43) MAPK1CA12CA1CA2CA7
SCHEMBL11780103 0.87 ESR1 (0.43) MAPK1CA12CA1CA2CA7
SCHEMBL4875288 0.85 MAPK1 (0.53) MAPK1CA12CA1CA2CA7
SCHEMBL1552057 0.85 MAPK1 (0.41) MAPK1CA12CA1CA2CA7
SCHEMBL16585706 0.85 PTPN1 (0.50) MAPK1CA12CA1CA2CA7
SCHEMBL10483374 0.84 THRB (0.43) MAPK1CA12CA1CA2CA7
SCHEMBL1039198 0.84 MAPK1 (0.36) MAPK1CA12CA1CA2CA7
SCHEMBL9649492 0.82 ESR1 (0.44) MAPK1HSD17B10KDM4EHPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2739169-B1 POROUS CATALYTIC MATRICES FOR ELIMINATION OF TOXICANTS FOUND IN TOBACCO COMBUSTION PRODUCTS MASSACHUSETTS INST TECHNOLOGY (US) 2019-06-12 EP claimed
EP-2485880-B1 IMPREGNATION OF CHEMICALS INTO WOOD UPM PLYWOOD OY (FI) 2018-12-26 EP claimed
EP-3271500-B1 ACTIVATION METHOD FOR SILICON SUBSTRATES ATOTECH DEUTSCHLAND GMBH (DE) 2018-06-20 EP claimed
EP-2989144-B1 POLYIMIDES, PROCESSES FOR PRODUCING SAID POLYIMIDES AND ARTICLES OBTAINED FROM SAID POLYIMIDES RHODIA OPERATIONS (FR) 2017-05-17 EP claimed
EP-2004589-B1 PROCESS FOR PREPARING POROUS METAL-ORGANIC FRAMEWORK MATERIALS BASF SE (DE) 2017-04-12 EP claimed
EP-2931772-B1 POROUS BRANCHED/HIGHLY BRANCHED POLYIMIDES BASF SE (DE) 2017-02-22 EP claimed
EP-2831035-B1 QUATERNARY AMMONIUM HYDROXIDES SACHEM INC (US) 2016-10-26 EP claimed
EP-2431426-B1 Modified pigments and inkjet ink compositions comprising modified pigments CABOT CORP (US) 2015-09-09 EP claimed
EP-2431425-B1 Modified colorants and inkjet ink compositions comprising modified colorants CABOT CORP (US) 2015-03-11 EP claimed
EP-2431427-B1 Modified colorants and inkjet ink compositions comprising modified colorants CABOT CORP (US) 2014-12-31 EP claimed
EP-1943317-B1 ARYLTRICARBOXYL-ATTACHED PIGMENT-BASED INKS WITH IMPROVED SLEWING DECAP HEWLETT PACKARD DEVELOPMENT CO (US) 2008-12-24 EP claimed
EP-1858834-B1 BIOLOGICALLY DEGRADABLE GAS HYDRATE INHIBITORS CLARIANT PRODUKTE DEUTSCHLAND (DE) 2008-10-08 EP claimed
EP-1024965-B9 PROCESS FOR REMOVING RESIDUES FROM A SEMICONDUCTOR SUBSTRATE ARCH SPEC CHEM INC (US) 2006-11-02 EP claimed
EP-1230334-B1 NON-CORROSIVE CLEANING COMPOSITION FOR REMOVING PLASMA ETCHING RESIDUES FUJIFILM ELECTRONIC MATERIALS (US) 2006-09-20 EP claimed
EP-1024965-B1 PROCESS FOR REMOVING RESIDUES FROM A SEMICONDUCTOR SUBSTRATE ARCH SPEC CHEM INC (US) 2006-06-14 EP claimed
EP-1141444-B1 NOVEL COMPOSITION FOR SELECTIVE ETCHING OF OXIDES OVER METALS FUJIFILM ELECTRONIC MATERIALS (US) 2006-06-14 EP claimed
EP-1129145-B1 NON-CORROSIVE STRIPPING AND CLEANING COMPOSITION ARCH SPEC CHEM INC (US) 2004-10-20 EP claimed
EP-1167359-B1 Process for the preparation of 2-arylbenzimidazole sulphonic acids MERCK PATENT GMBH (DE) 2004-04-28 EP claimed
EP-0852009-B1 BUFFER COMPOSITION FOR REAGENTS FOR IMMUNOASSAY ABBOTT LAB (US) 2002-08-28 EP claimed
EP-1167359-A1 Process for the preparation of 2-arylbenzimidazole sulphonic acids and their use as UV-filters MERCK PATENT GmbH (DE) 2002-01-02 EP claimed