SCHEMBL23912940

SCHEMBL23912940

O=Nc1c2ccccc2c(O)c2c(O)ccc(O)c12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.62
GRIN2D O15399 1/20 0.42
GRIN3B O60391 1/20 0.42
GRIN1 Q05586 1/20 0.42
GRIN2A Q12879 1/20 0.42
GRIN2B Q13224 1/20 0.42
GRIN2C Q14957 1/20 0.42
GRIN3A Q8TCU5 1/20 0.42
PIM1 P11309 1/20 0.41
IDO1 P14902 1/20 0.39
MAPT P10636 5/20 0.39
TDP1 Q9NUW8 3/20 0.39
ALOX15 P16050 2/20 0.39
TSHR P16473 2/20 0.39
RECQL P46063 2/20 0.39
THRB P10828 2/20 0.39
APP P05067 1/20 0.39
HPGD P15428 1/20 0.39
CASP1 P29466 1/20 0.39
SNCA P37840 1/20 0.39

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
SCHEMBL145008 0.81 PIM1 (0.61) HSP90AA1PIM1IDO1MAPTTDP1
SCHEMBL29635249 0.81 PIM1 (0.61) HSP90AA1PIM1IDO1MAPTTDP1
SCHEMBL2599158 0.77 HSP90AA1 (1.00) HSP90AA1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7202159 0.75 HSP90AA1 (0.79) HSP90AA1GRIN2DGRIN3BGRIN1GRIN2A
Tetroquinone SCHEMBL2351288 0.74 PIM1 (0.46) HSP90AA1PIM1IDO1MAPTTDP1
SCHEMBL10025575 0.71 HSP90AA1 (0.64) HSP90AA1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8179362 0.71 HSP90AA1 (0.70) HSP90AA1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL9296347 0.69 HSP90AA1 (0.57) HSP90AA1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL2922254 0.69 HSP90AA1 (0.50) HSP90AA1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL103998 0.68 THRB (0.59) HSP90AA1MAPTTDP1RECQLTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3653735-B1 REPTILE SKIN PRODUCT AND PRODUCTION METHOD FOR REPTILE SKIN PRODUCT CITIZEN WATCH CO LTD (JP) 2021-10-13 EP disclosed