SCHEMBL7999037

SCHEMBL7999037

CCCCCCOc1c(O)c2ccc(NCc3ccccc3)cc2n(CC)c1=O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.43
POLB P06746 1/20 0.42
KDM4E B2RXH2 4/20 0.41
HTT P42858 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CNR2 P34972 1/20 0.41
GSK3B P49841 6/20 0.41
LMNA P02545 4/20 0.41
TDP1 Q9NUW8 3/20 0.41
HDAC11 Q96DB2 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
TP53 P04637 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL8001141 0.94 POLB (0.45) ADRA2APOLBKDM4EHTTSMN1; SMN2
SCHEMBL8000524 0.94 KDM4E (0.49) ADRA2APOLBKDM4EHTTSMN1; SMN2
SCHEMBL8001220 0.90 KDM4E (0.43) ADRA2APOLBKDM4EHTTSMN1; SMN2
SCHEMBL8001352 0.87 ADRA2A (0.48) ADRA2APOLBKDM4EHTTSMN1; SMN2
SCHEMBL7997311 0.86 POLB (0.43) ADRA2APOLBKDM4EHTTSMN1; SMN2
SCHEMBL7988983 0.85 ADRA2A (0.51) ADRA2APOLBKDM4EHTTSMN1; SMN2
SCHEMBL8000857 0.85 ADRA2A (0.51) ADRA2APOLBKDM4EHTTSMN1; SMN2
SCHEMBL8001038 0.85 ADRA2A (0.48) ADRA2APOLBKDM4EHTTSMN1; SMN2
SCHEMBL8001321 0.85 KDM4E (0.46) ADRA2APOLBKDM4EHTTSMN1; SMN2
SCHEMBL7988631 0.84 ADRA2A (0.50) ADRA2APOLBKDM4EHTTSMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6114352-A Quinolinone derivative and anti-allergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-09-05 US disclosed
EP-0785190-B1 Quinolinone derivative and antiallergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK & CHEMICALS (JP) 2000-08-16 EP disclosed
US-5942521-A Quinolinone derivative and anti-allergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-08-24 US disclosed
EP-0785190-A2 Quinolinone derivative and antiallergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 1997-07-23 EP disclosed