SCHEMBL7530798

SCHEMBL7530798

CC(=O)CC(=O)Nc1cc(C(=O)O)ccc1Cl

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.57
MAPT P10636 1/20 0.57
HTT P42858 1/20 0.56
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
POLB P06746 3/20 0.54
NPC1 O15118 1/20 0.53
ALOX12 P18054 1/20 0.53
CASR P41180 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.49
TSHR P16473 2/20 0.49
PPARG P37231 1/20 0.48
NR1H4 Q96RI1 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
LTB4R Q15722 1/20 0.47
HPGD P15428 1/20 0.46

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
SCHEMBL11051962 0.88 PDK1 (0.55) ALDH1A1MAPTHTTMEN1KMT2A
SCHEMBL7527111 0.86 KMT2A (0.53) ALDH1A1MAPTHTTMEN1KMT2A
SCHEMBL1459456 0.83 ALDH1A1 (0.71) ALDH1A1MAPTHTTMEN1KMT2A
SCHEMBL11547184 0.83 CYP1A2 (0.70) ALDH1A1MAPTHTTMEN1KMT2A
Hydrochloric Acid SCHEMBL9320200 0.83 ALDH1A1 (0.58) ALDH1A1MAPTHTTMEN1KMT2A
SCHEMBL2558622 0.83 SELL (0.62) ALDH1A1MAPTMEN1KMT2ANPC1
SCHEMBL7078702 0.83 KDM4E (0.51) ALDH1A1MAPTMEN1KMT2ANPC1
SCHEMBL54924 0.82 MEN1 (0.80) ALDH1A1MAPTHTTMEN1KMT2A
SCHEMBL12010982 0.82 KMT2A (0.67) ALDH1A1MAPTHTTMEN1KMT2A
SCHEMBL2556020 0.81 EP300 (0.51) ALDH1A1MAPTHTTMEN1KMT2A

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 7 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
EP-0952191-A2 Disazo pigment composition, printing ink containing the same and a method for manufacturing the same DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-10-27 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