SCHEMBL8002143

SCHEMBL8002143

CCCCCCCCn1c(=O)c(OCC(C)CCC)c(O)c2ccc(NCc3ccccc3)cc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.44
HTT P42858 4/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ADRA2A P08913 1/20 0.43
HPGD P15428 3/20 0.43
LMNA P02545 2/20 0.43
TP53 P04637 1/20 0.43
POLB P06746 3/20 0.42
MAPT P10636 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
ALDH1A1 P00352 2/20 0.40
USP2 O75604 1/20 0.40
PKM P14618 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
ALOX12 P18054 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
PSEN1 P49768 4/20 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
SCHEMBL8002274 0.90 ADRA2A (0.43) KDM4EHTTSMN1; SMN2ADRA2AHPGD
SCHEMBL7999747 0.90 ADRA2A (0.43) KDM4EHTTSMN1; SMN2ADRA2AHPGD
SCHEMBL7988797 0.90 ADRA2A (0.43) KDM4EHTTSMN1; SMN2ADRA2AHPGD
SCHEMBL8000524 0.89 KDM4E (0.49) KDM4EHTTSMN1; SMN2ADRA2AHPGD
SCHEMBL7999006 0.87 ADRA2A (0.40) KDM4EHTTSMN1; SMN2ADRA2AHPGD
SCHEMBL7999001 0.87 ADRA2A (0.40) KDM4EHTTSMN1; SMN2ADRA2AHPGD
SCHEMBL8080800 0.86 MEN1 (0.48) HTTSMN1; SMN2LMNAPOLBMEN1
SCHEMBL8001141 0.85 POLB (0.45) KDM4EHTTSMN1; SMN2ADRA2AHPGD
SCHEMBL8001321 0.85 KDM4E (0.46) KDM4EHTTSMN1; SMN2ADRA2AHPGD
SCHEMBL7999037 0.83 ADRA2A (0.43) KDM4EHTTSMN1; SMN2ADRA2AHPGD

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