SCHEMBL980362

SCHEMBL980362

O=c1oc2cc(O)ccc2cc1-c1cccc(O)c1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 11/20 0.80
NPC1 O15118 3/20 0.80
GAPDH P04406 1/20 0.78
PTGS1 P23219 1/20 0.77
ESR2 Q92731 2/20 0.74
MEN1 O00255 3/20 0.67
KMT2A Q03164 3/20 0.67
KDM4E B2RXH2 2/20 0.67
ALDH1A1 P00352 2/20 0.67
GLA P06280 2/20 0.67
HPGD P15428 2/20 0.67
TDP1 Q9NUW8 2/20 0.67
RAB9A P51151 2/20 0.67
POLB P06746 1/20 0.67
GAA P10253 1/20 0.67
NPSR1 Q6W5P4 1/20 0.67
MAOA P21397 1/20 0.66
MAOB P27338 1/20 0.66
ERAP1 Q9NZ08 2/20 0.63
MAPT P10636 1/20 0.63

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
SCHEMBL591688 0.89 MIF (1.00) MIFNPC1GAPDHPTGS1ESR2
SCHEMBL8117543 0.88 MIF (1.00) MIFNPC1GAPDHPTGS1ESR2
SCHEMBL5085018 0.88 MIF (0.72) MIFNPC1GAPDHPTGS1ESR2
SCHEMBL22132745 0.88 GAPDH (1.00) MIFNPC1GAPDHPTGS1ESR2
SCHEMBL22132860 0.88 MAOB (0.79) MIFNPC1GAPDHPTGS1ESR2
SCHEMBL28142014 0.87 PTGS1 (1.00) MIFNPC1PTGS1ESR2MEN1
SCHEMBL2166723 0.85 ESR2 (1.00) MIFNPC1GAPDHPTGS1ESR2
SCHEMBL28596131 0.85 MIF (1.00) MIFNPC1GAPDHPTGS1ESR2
SCHEMBL30108442 0.85 MIF (1.00) MIFNPC1GAPDHPTGS1ESR2
SCHEMBL27736901 0.84 MIF (0.65) MIFNPC1GAPDHPTGS1ESR2

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
US-7772334-B2 Crosslinker of reactive functional groups and nonionic metal coordinating structure-containing alkyl or aromatic compound BASF COATINGS GMBH (DE) 2010-08-10 US claimed
US-7759436-B2 Film-former of resin with nonionic metal coordinating structure and crosslinker-reactive group BASF COATINGS GMBH (DE) 2010-07-20 US claimed
EP-2076560-B1 METAL COORDINATING AND FILM-FORMING MATERIALS BASF COATINGS GMBH (DE) 2016-05-04 EP disclosed
US-7867570-B2 Method of producing a coating having metal coordinating and film-forming materials BASF COATINGS GMBH (DE) 2011-01-11 US disclosed
EP-2076555-B1 METAL COORDINATING AND FILM-FORMING MATERIALS BASF CORP (US) 2011-01-05 EP disclosed
US-7772334-B2 Crosslinker of reactive functional groups and nonionic metal coordinating structure-containing alkyl or aromatic compound BASF COATINGS GMBH (DE) 2010-08-10 US disclosed
US-7759436-B2 Film-former of resin with nonionic metal coordinating structure and crosslinker-reactive group BASF COATINGS GMBH (DE) 2010-07-20 US disclosed
EP-2084236-A1 METHOD OF PRODUCING A COATING HAVING METAL COORDINATING AND FILM-FORMING MATERIALS BASF Corporation (US) 2009-08-05 EP disclosed
EP-2076555-A1 METAL COORDINATING AND FILM-FORMING MATERIALS BASF Corporation (US) 2009-07-08 EP disclosed
EP-2076560-A2 METAL COORDINATING AND FILM-FORMING MATERIALS BASF Corporation (US) 2009-07-08 EP disclosed
WO-2008057643-A2 METAL COORDINATING AND FILM-FORMING MATERIALS BASF CORPORATION (US) 2008-05-15 WO disclosed
WO-2008051648-A1 METAL COORDINATING AND FILM-FORMING MATERIALS BASF CORPORATION (US) 2008-05-02 WO disclosed
WO-2008051649-A1 METHOD OF PRODUCING A COATING HAVING METAL COORDINATING AND FILM-FORMING MATERIALS BASF CORPORATION (US) 2008-05-02 WO disclosed
US-20080102214-A1 METHOD OF PRODUCING A COATING HAVING METAL COORDINATING AND FILM-FORMING MATERIALS BASF CORPORATION (US) 2008-05-01 US disclosed
US-20080103268-A1 Substrate adhesion, reduced cure temperatures, simple production; electrocoatings BASF CORPORATION (US) 2008-05-01 US disclosed
US-20080103269-A1 METAL COORDINATING AND FILM-FORMING MATERIALS BASF CORPORATION (US) 2008-05-01 US disclosed