SCHEMBL8004097

SCHEMBL8004097

CCCCCCOc1c(O)c2ccc(N(C)C)cc2n(CCCC)c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.43
MAPT P10636 2/20 0.43
ALDH1A1 P00352 6/20 0.42
HPGD P15428 5/20 0.42
LMNA P02545 3/20 0.42
HTT P42858 3/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
HSD17B10 Q99714 2/20 0.41
THRB P10828 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TP53 P04637 1/20 0.39
CNR2 P34972 2/20 0.39
SIRT2 Q8IXJ6 1/20 0.39
PSEN1 P49768 3/20 0.38
PSEN2 P49810 3/20 0.38
APH1B Q8WW43 3/20 0.38
NCSTN Q92542 3/20 0.38
APH1A Q96BI3 3/20 0.38
PSENEN Q9NZ42 3/20 0.38
RORA P35398 1/20 0.38

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
SCHEMBL6581271 0.89 ALDH1A1 (0.48) KDM4EMAPTALDH1A1HPGDHTT
SCHEMBL8004925 0.89 ALDH1A1 (0.48) KDM4EMAPTALDH1A1HPGDHTT
SCHEMBL7999652 0.85 KDM4E (0.44) KDM4EMAPTALDH1A1HPGDLMNA
SCHEMBL8001735 0.85 KDM4E (0.44) KDM4EMAPTALDH1A1HPGDLMNA
SCHEMBL7998533 0.83 KDM4E (0.46) KDM4EMAPTALDH1A1HPGDLMNA
SCHEMBL7989113 0.83 ALDH1A1 (0.47) KDM4EMAPTALDH1A1HPGDSMN1; SMN2
SCHEMBL7997334 0.83 KDM4E (0.46) KDM4EMAPTALDH1A1HPGDLMNA
SCHEMBL7999961 0.83 KDM4E (0.46) KDM4EMAPTALDH1A1HPGDLMNA
SCHEMBL7998893 0.83 KDM4E (0.46) KDM4EMAPTALDH1A1HPGDLMNA
SCHEMBL7997085 0.82 ALDH1A1 (0.43) KDM4EMAPTALDH1A1HPGDLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1158265-C Quinoline ketone derivant and antianaphylaction using same as active substance ���ձ���ī��ѧ��ҵ��ʽ���� 2004-07-21 CN disclosed
CN-1095834-C Quinolinone derivatives and antiallergic agent containing said quinolinone derivatives as active ingredient DAINIPPON INK & CHEMICALS (JP) 2002-12-11 CN disclosed
CN-1275564-A Quinoline ketone derivant and antianaphylaction using same as active substance DAINIPPON INK & CHEMICALS (JP) 2000-12-06 CN disclosed
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
CN-1163268-A Quinolinone derivatives and antiallergic agent containing said quinolinone derivatives as active ingredient LAINIPPON INK AND CHEMICALC IN (JP) 1997-10-29 CN 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