SCHEMBL10936271

SCHEMBL10936271

CC(=O)CC(=O)Nc1nc2cccc(Cl)c2s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
RECQL P46063 1/20 0.50
POLB P06746 1/20 0.48
NPC1 O15118 4/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
ACP1 P24666 1/20 0.46
ALOX5 P09917 1/20 0.46
UBE2N P61088 1/20 0.46
PSMB8 P28062 1/20 0.46
CSNK1D P48730 3/20 0.45
MAPK1 P28482 2/20 0.45
ALDH1A1 P00352 3/20 0.45
KDM4E B2RXH2 3/20 0.45
HTT P42858 3/20 0.45
HSD17B10 Q99714 1/20 0.45
ADORA1 P30542 2/20 0.45
DYRK1A Q13627 1/20 0.44
MAPT P10636 2/20 0.43

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
SCHEMBL10935261 0.84 RAB9A (0.51) RAB9AMEN1KMT2APOLBNPC1
SCHEMBL10598617 0.83 MEN1 (0.54) RAB9AMEN1KMT2APOLBNPC1
SCHEMBL4866541 0.82 RAB9A (0.52) RAB9AMEN1KMT2ARECQLPOLB
SCHEMBL10939456 0.80 GAA (0.63) RAB9AMEN1KMT2ARECQLNPC1
SCHEMBL3933070 0.78 DYRK1A (0.72) RAB9AMEN1KMT2APOLBNPC1
SCHEMBL10872042 0.78 NPC1 (0.53) RAB9AMEN1KMT2APOLBNPC1
SCHEMBL5928965 0.74 DYRK1A (0.75) RAB9AMEN1KMT2APOLBNPC1
SCHEMBL10935898 0.74 DYRK1A (0.59) RAB9AMEN1KMT2APOLBNPC1
SCHEMBL9675948 0.74 PSMB8 (0.57) RAB9AMEN1KMT2APOLBNPC1
SCHEMBL5091421 0.73 NPC1 (0.66) RAB9AMEN1KMT2ANPC1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0051560-B1 MONOAZOPIGMENTS CONTAINING HETEROCYCLIC NUCLEI, THEIR PREPARATION AND USE CIBA-GEIGY AG (CH) 1985-01-16 EP disclosed
US-4400319-A Monoazo pigments containing heterocycles, and high-molecular organic materials dyed therewith CIBA-GEIGY CORPORATION (US) 1983-08-23 US disclosed
EP-0051560-A1 Monoazopigments containing heterocyclic nuclei, their preparation and use CIBA-GEIGY AG (CH) 1982-05-12 EP disclosed