SCHEMBL5694486

SCHEMBL5694486

O=C(O)Cc1c[nH]c2cccc(C(=O)O)c12

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.69
KDM4E B2RXH2 3/20 0.69
GAA P10253 2/20 0.69
MEN1 O00255 2/20 0.69
MAPT P10636 2/20 0.69
KMT2A Q03164 2/20 0.69
POLB P06746 1/20 0.69
THRB P10828 1/20 0.69
DNMT1 P26358 1/20 0.69
RECQL P46063 1/20 0.69
CASP6 P55212 1/20 0.69
MCL1 Q07820 1/20 0.69
TDP1 Q9NUW8 1/20 0.69
L3MBTL1 Q9Y468 1/20 0.69
NPSR1 Q6W5P4 2/20 0.51
TSHR P16473 2/20 0.45
HPGD P15428 2/20 0.45
LMNA P02545 1/20 0.45
GLA P06280 1/20 0.45
CYP2C9 P11712 1/20 0.45

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
SCHEMBL27571206 0.85 MEN1 (0.51) ALDH1A1KDM4EGAAMEN1MAPT
Hydrochloric Acid SCHEMBL5008105 0.83 KDM4E (0.48) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL29441752 0.82 ALDH1A1 (1.00) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL5066497 0.82 ALDH1A1 (0.71) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL7358453 0.82 ALDH1A1 (1.00) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL29441750 0.82 ALDH1A1 (1.00) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL28440788 0.81 MEN1 (0.53) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL28796482 0.81 HTR2C (0.63) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL6287959 0.81 ALDH1A1 (0.69) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL3562093 0.81 ALDH1A1 (0.69) ALDH1A1KDM4EGAAMEN1MAPT

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