SCHEMBL5694491

SCHEMBL5694491

O=C(O)Cc1cc2cccc(CC(=O)O)c2[nH]1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.51
GRIN3B O60391 1/20 0.51
GRIN1 Q05586 1/20 0.51
GRIN2A Q12879 1/20 0.51
GRIN2B Q13224 1/20 0.51
GRIN2C Q14957 1/20 0.51
GRIN3A Q8TCU5 1/20 0.51
TDP1 Q9NUW8 2/20 0.50
DAO P14920 1/20 0.43
AKR1B1 P15121 1/20 0.43
FLT3 P36888 1/20 0.41
STING1 Q86WV6 1/20 0.40
MEN1 O00255 3/20 0.40
ALDH1A1 P00352 3/20 0.40
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 3/20 0.40
DUSP3 P51452 1/20 0.38
PTPN5 P54829 1/20 0.38
PTPN11 Q06124 1/20 0.38
CTDSP1 Q9GZU7 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
SCHEMBL28706901 0.83 GRIN2D (0.44) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL27568957 0.82 NSD2 (0.54) DAOMEN1ALDH1A1KMT2AKDM4E
SCHEMBL7785465 0.82 DAO (0.51) TDP1DAOAKR1B1KMT2AKDM4E
SCHEMBL11199718 0.78 MTNR1A (0.62) TDP1FLT3STING1MEN1ALDH1A1
SCHEMBL3428192 0.77 HRH4 (0.52) MEN1ALDH1A1KMT2AKDM4EUSP2
SCHEMBL27942805 0.77 APEX1 (0.68) TDP1MEN1KMT2AKDM4ECTDSP1
SCHEMBL3424005 0.75 MTNR1A (0.43) FLT3MEN1ALDH1A1KMT2AKDM4E
SCHEMBL49270 0.74 LOXL2 (0.56) DAOAKR1B1FLT3ALDH1A1KDM4E
SCHEMBL31336079 0.74 LOXL2 (0.56) DAOAKR1B1FLT3ALDH1A1KDM4E
SCHEMBL29365671 0.74 LOXL2 (0.56) DAOAKR1B1FLT3ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1539492-B1 HIGH SPEED NEGATIVE-WORKING THERMAL PRINTING PLATES KODAK POLYCHROME GRAPHICS LLC (US) 2006-05-17 EP disclosed
EP-1539492-A1 HIGH SPEED NEGATIVE-WORKING THERMAL PRINTING PLATES Kodak Polychrome Graphics, LLC (US) 2005-06-15 EP disclosed
US-6899992-B2 Polymerizable compounds with quadruple hydrogen bond forming groups KODAK POLYCHROME GRAPHICS LLC (US) 2005-05-31 US disclosed
US-6893797-B2 High speed negative-working thermal printing plates KODAK POLYCHROME GRAPHICS LLC (US) 2005-05-17 US disclosed
WO-2004043935-A1 POLYMERIZABLE COMPOUNDS WITH QUADRUPLE HYDROGEN BOND FORMING GROUPS KODAK POLYCHROME GRAPHICS LLC (US) 2004-05-27 WO disclosed
US-20040091812-A1 Polymerizable compounds with quadruple hydrogen bond forming groups KODAK AMERICAS LTD. 2004-05-13 US disclosed
WO-2004014652-A1 HIGH SPEED NEGATIVE-WORKING THERMAL PRINTING PLATES KODAK POLYCHROME GRAPHICS LLC (US) 2004-02-19 WO disclosed
US-20030124460-A1 High speed negative-working thermal printing plates KODAK PHILIPPINES LTD. 2003-07-03 US disclosed