SCHEMBL4398385

SCHEMBL4398385

CC(=O)CC(=O)NOC(=O)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.59
MAPT P10636 4/20 0.59
KMT2A Q03164 4/20 0.59
POLB P06746 1/20 0.59
TSHR P16473 3/20 0.52
LMNA P02545 2/20 0.45
F2 P00734 1/20 0.45
TDP1 Q9NUW8 4/20 0.43
MAPK1 P28482 2/20 0.42
SLC6A3 Q01959 2/20 0.42
HIF1A Q16665 1/20 0.42
SLC6A2 P23975 1/20 0.42
PKM P14618 1/20 0.41
CASP3 P42574 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
HPGD P15428 2/20 0.41
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 1/20 0.41

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
SCHEMBL28047943 0.85 ALDH1A1 (0.63) ALDH1A1MAPTKMT2APOLBTSHR
SCHEMBL28770702 0.84 ALDH1A1 (0.61) ALDH1A1MAPTKMT2APOLBTSHR
SCHEMBL28336638 0.81 KMT2A (0.63) ALDH1A1MAPTKMT2APOLBTSHR
SCHEMBL1107202 0.81 ALDH1A1 (0.68) ALDH1A1MAPTKMT2APOLBTSHR
SCHEMBL5199420 0.80 ALDH1A1 (0.61) ALDH1A1MAPTKMT2APOLBTSHR
SCHEMBL3986708 0.80 KMT2A (0.61) ALDH1A1MAPTKMT2APOLBTSHR
SCHEMBL30483928 0.80 MAPT (0.61) ALDH1A1MAPTKMT2APOLBTSHR
SCHEMBL28690495 0.80 KMT2A (0.61) ALDH1A1MAPTKMT2APOLBTSHR
SCHEMBL7645360 0.79 ALDH1A1 (0.66) ALDH1A1MAPTKMT2APOLBTSHR
SCHEMBL28603708 0.79 KMT2A (0.59) ALDH1A1MAPTKMT2APOLBTSHR

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
WO-2019238067-A1 PYRROLO [2, 3-B] PYRIDINES OR PYRROLO [2, 3-B] PYRAZINES AS HPK1 INHIBITOR AND THE USE THEREOF BEIGENE, LTD. (KY) 2019-12-19 WO disclosed
WO-2009069314-A2 PIGMENT COMPOSITION, AND POLYMERIZED TONER TOYO INK MFG. CO., LTD. (JP) 2009-06-04 WO 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
EP-0823459-A2 Disazo pigment composition and printing ink DAINIPPON INK AND CHEMICALS, INC. (JP) 1998-02-11 EP disclosed