SCHEMBL7529550

SCHEMBL7529550

CC(=O)CC(=O)Nc1ccc(C(=O)O)c(O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.56
PKM P14618 1/20 0.56
STAT3 P40763 1/20 0.54
CTDSP1 Q9GZU7 1/20 0.54
SIRT5 Q9NXA8 1/20 0.54
ALDH1A1 P00352 5/20 0.54
KDM4E B2RXH2 2/20 0.54
MEN1 O00255 2/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2C19 P33261 1/20 0.54
HIF1A Q16665 1/20 0.54
MAPT P10636 1/20 0.53
POLB P06746 2/20 0.53
KDM4C Q9H3R0 1/20 0.52
ATM Q13315 1/20 0.52
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA7 P43166 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CA4 P22748 1/20 0.50

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
SCHEMBL7077248 0.87 KDM4C (0.68) KMT2APKMALDH1A1KDM4EMEN1
SCHEMBL14392276 0.85 KMT2A (0.58) KMT2APKMSTAT3CTDSP1SIRT5
SCHEMBL13593266 0.85 KMT2A (0.61) KMT2APKMSTAT3CTDSP1SIRT5
SCHEMBL4385068 0.84 POLB (0.57) KMT2APKMALDH1A1KDM4EMEN1
SCHEMBL16221621 0.83 KMT2A (0.59) KMT2APKMSTAT3CTDSP1SIRT5
SCHEMBL729994 0.83 SMN1; SMN2 (0.70) KMT2APKMSTAT3CTDSP1SIRT5
SCHEMBL4386933 0.83 ALDH1A1 (0.53) KMT2AALDH1A1KDM4EMEN1CYP1A2
SCHEMBL28504512 0.83 KMT2A (0.53) KMT2AALDH1A1KDM4EMEN1CYP1A2
SCHEMBL2128835 0.83 ALDH1A1 (0.68) KMT2APKMSTAT3CTDSP1SIRT5
SCHEMBL11060481 0.82 KMT2A (0.58) KMT2APKMSTAT3CTDSP1SIRT5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1134517-C Disazo pigment composition and printing ink 3M 2004-01-14 CN disclosed
EP-0952191-B1 Disazo pigment composition, printing ink containing the same and a method for manufacturing the same DAINIPPON INK & CHEMICALS (JP) 2002-07-10 EP disclosed
EP-0823459-B1 Disazo pigment composition and printing ink DAINIPPON INK & CHEMICALS (JP) 2002-04-17 EP disclosed
US-5803962-A Disazo pigment composition and printing ink DAINIPPON INK AND CHEMICALS, INC. (JP) 1998-09-08 US disclosed
CN-1175607-A Tetrazo pigment composition and printing ink DAINIPPON INK & CHEMICALS (JP) 1998-03-11 CN disclosed
EP-0823459-A2 Disazo pigment composition and printing ink DAINIPPON INK AND CHEMICALS, INC. (JP) 1998-02-11 EP disclosed