SCHEMBL10596177

SCHEMBL10596177

CC(=O)CC(=O)Nc1nc2ccc(NC(C)=O)cc2s1

nearest known ligand 0.81

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.81
SMN1; SMN2 Q16637 2/20 0.77
LDHA P00338 2/20 0.71
MAPT P10636 11/20 0.69
POLB P06746 3/20 0.69
KDM4E B2RXH2 9/20 0.68
MEN1 O00255 5/20 0.67
KMT2A Q03164 5/20 0.67
LMNA P02545 3/20 0.67
GAA P10253 3/20 0.67
TDP1 Q9NUW8 3/20 0.67
RECQL P46063 2/20 0.67
ALDH1A1 P00352 5/20 0.64
NPC1 O15118 3/20 0.62
HPGD P15428 2/20 0.61
HTT P42858 1/20 0.61
HSD17B10 Q99714 1/20 0.61

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
SCHEMBL10600068 0.90 RAB9A (0.81) RAB9ASMN1; SMN2LDHAMAPTPOLB
SCHEMBL10596662 0.90 RAB9A (0.65) RAB9ASMN1; SMN2LDHAMAPTPOLB
SCHEMBL10871205 0.89 RAB9A (0.65) RAB9ASMN1; SMN2LDHAMAPTPOLB
SCHEMBL10596351 0.88 RAB9A (0.82) RAB9ASMN1; SMN2LDHAMAPTPOLB
SCHEMBL10597936 0.88 RAB9A (0.63) RAB9ASMN1; SMN2LDHAMAPTPOLB
SCHEMBL10872585 0.86 CASP3 (0.70) RAB9ASMN1; SMN2MAPTPOLBKDM4E
SCHEMBL10873161 0.85 MAPT (0.61) RAB9ASMN1; SMN2MAPTPOLBKDM4E
SCHEMBL10871696 0.85 RAB9A (0.67) RAB9ASMN1; SMN2MAPTPOLBKDM4E
SCHEMBL10872798 0.84 RAB9A (0.63) RAB9ASMN1; SMN2LDHAMAPTPOLB
SCHEMBL10936133 0.84 DYRK1A (0.74) RAB9ASMN1; SMN2MAPTPOLBKDM4E

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
EP-0138761-B1 PROCESS FOR THE PIGMENTATION OF MACROMOLECULAR ORGANIC MATERIALS CIBA-GEIGY AG (CH) 1989-03-22 EP disclosed
US-4602961-A MONOAZO BENZOTHIAZOLE DERIVATIVES CIBA-GEIGY CORPORATION (US) 1986-07-29 US disclosed
EP-0138761-A2 Process for the pigmentation of macromolecular organic materials CIBA-GEIGY AG (CH) 1985-04-24 EP disclosed
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