SCHEMBL5694492

SCHEMBL5694492

O=C(O)Cc1c[nH]c2c(CC(=O)O)cccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.53
GRIN2D O15399 1/20 0.50
GRIN3B O60391 1/20 0.50
GRIN1 Q05586 1/20 0.50
GRIN2A Q12879 1/20 0.50
GRIN2B Q13224 1/20 0.50
GRIN2C Q14957 1/20 0.50
GRIN3A Q8TCU5 1/20 0.50
ALDH1A1 P00352 4/20 0.49
KDM4E B2RXH2 4/20 0.49
MEN1 O00255 4/20 0.49
MAPT P10636 4/20 0.49
KMT2A Q03164 4/20 0.49
TSHR P16473 2/20 0.49
LMNA P02545 2/20 0.49
HPGD P15428 2/20 0.49
GAA P10253 2/20 0.49
GLA P06280 1/20 0.49
CYP2C9 P11712 1/20 0.49
NFKB1 P19838 1/20 0.49

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
SCHEMBL6131640 0.92 ALDH1A1 (0.57) TDP1ALDH1A1KDM4EMEN1MAPT
SCHEMBL17102847 0.88 ALDH1A1 (0.59) TDP1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL5058671 0.86 ALDH1A1 (0.46) TDP1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL6284097 0.85 HTR2A (0.58) TDP1ALDH1A1KDM4EMEN1MAPT
SCHEMBL6516641 0.85 HTR2A (0.58) TDP1ALDH1A1KDM4EMEN1MAPT
SCHEMBL5066540 0.85 GPR84 (0.65) TDP1ALDH1A1KDM4EMEN1MAPT
SCHEMBL5058656 0.85 ALDH1A1 (0.45) TDP1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL27612164 0.84 SOS2 (0.62) TDP1KDM4EMEN1MAPTKMT2A
SCHEMBL21808835 0.81 MTNR1A (0.62) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL30708156 0.81 MTNR1A (0.62) ALDH1A1KDM4EMEN1MAPTKMT2A

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