SCHEMBL11334635

SCHEMBL11334635

Cc1cc(N)cc2[nH]c(=O)oc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 5/20 0.42
NOS2 P35228 4/20 0.42
NOS3 P29474 3/20 0.42
KMO O15229 1/20 0.36
RPS6KA3 P51812 1/20 0.35
GRIN2D O15399 1/20 0.34
GRIN3B O60391 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2A Q12879 1/20 0.34
GRIN2B Q13224 1/20 0.34
GRIN2C Q14957 1/20 0.34
GRIN3A Q8TCU5 1/20 0.34
OGT O15294 1/20 0.34
TSHR P16473 2/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34
ADRA2A P08913 1/20 0.34
THPO P40225 1/20 0.34
BLM P54132 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL2149212 0.80 NOS1 (0.53) NOS1NOS2NOS3KMOGRIN2D
SCHEMBL5362090 0.79 KMO (0.47) NOS1NOS2NOS3KMOGRIN2D
SCHEMBL11690086 0.79 GAA (0.41) NOS1NOS2NOS3KMOOGT
SCHEMBL18062718 0.79 KMO (0.35) NOS1NOS2NOS3KMOOGT
SCHEMBL11689717 0.79 GRIN2D (0.39) NOS1NOS2NOS3GRIN2DGRIN3B
SCHEMBL18415160 0.77 NOS1 (0.42) NOS1NOS2NOS3KMOGRIN2D
SCHEMBL9380892 0.77 NOS1 (0.42) NOS1NOS2NOS3KMOGRIN2D
SCHEMBL4878589 0.77 NOS1 (0.46) NOS1NOS2NOS3KMOGRIN2D
SCHEMBL30445055 0.77 NOS1 (0.42) NOS1NOS2NOS3KMORPS6KA3
SCHEMBL16362079 0.77 NOS1 (0.42) NOS1NOS2NOS3KMORPS6KA3

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-0000737-B1 MONOAZO PIGMENTS OF THE ACETOACETYLAMINO BENZIMIDAZOLONE SERIES, THEIR PREPARATION AND THEIR USE FOR COLOURING ORGANIC MATERIAL OF HIGH MOLECULAR WEIGHT CIBA-GEIGY AG (CH) 1981-04-29 EP disclosed
EP-0000737-A1 Monoazo pigments of the acetoacetylamino benzimidazolone series, their preparation and their use for colouring organic material of high molecular weight CIBA-GEIGY AG (CH) 1979-02-21 EP disclosed
US-4012371-A Benzinaldazolyl-, quinolonyl-, or phenmorpholonylazo-3-cyano-4-methyl-1,2-[1',2']-benz-[4',5']-imidazolo-6-hydroxypyridine colorants CIBA-GEIGY CORPORATION (US) 1977-03-15 US disclosed