SCHEMBL6579245

SCHEMBL6579245

CCCCCCCCn1c(=O)c(Oc2ccccc2)c(O)c2cc(-c3ccccc3)ccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.56
MAPT P10636 1/20 0.56
ALDH1A1 P00352 5/20 0.50
ICMT O60725 2/20 0.50
HTT P42858 3/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HPGD P15428 3/20 0.47
LMNA P02545 2/20 0.47
TP53 P04637 1/20 0.47
GAA P10253 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
NPC1 O15118 1/20 0.43
PSEN1 P49768 2/20 0.43
PSEN2 P49810 2/20 0.43
APH1B Q8WW43 2/20 0.43
NCSTN Q92542 2/20 0.43
APH1A Q96BI3 2/20 0.43
PSENEN Q9NZ42 2/20 0.43
PGR P06401 2/20 0.43

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
SCHEMBL6579736 0.89 KDM4E (0.53) KDM4EMAPTALDH1A1HTTSMN1; SMN2
SCHEMBL7964597 0.88 CNR2 (0.54) KDM4EMAPTALDH1A1HTTSMN1; SMN2
SCHEMBL6577102 0.84 KDM4E (0.47) KDM4EMAPTALDH1A1HTTSMN1; SMN2
SCHEMBL6577106 0.84 KDM4E (0.47) KDM4EMAPTALDH1A1HTTSMN1; SMN2
SCHEMBL6581475 0.83 KDM4E (0.47) KDM4EMAPTALDH1A1HTTSMN1; SMN2
SCHEMBL6581473 0.83 KDM4E (0.47) KDM4EMAPTALDH1A1HTTSMN1; SMN2
SCHEMBL7980784 0.82 KDM4E (0.47) KDM4EMAPTALDH1A1HTTSMN1; SMN2
SCHEMBL12628255 0.77 CNR2 (0.54) KDM4EMAPTICMTPSEN1PSEN2
SCHEMBL6579397 0.76 PDE5A (0.49) KDM4EMAPTALDH1A1HTTSMN1; SMN2
SCHEMBL7974935 0.75 KCNA3 (0.52) KDM4EMAPTALDH1A1HTTSMN1; 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
EP-0927718-B1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK & CHEMICALS (JP) 2004-02-25 EP disclosed
US-6271416-B1 O-(HYDROCARBONOXYACETAMIDO)BENZOIC ACID DERIVATIVES AS INTERMEDIATES DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-08-07 US disclosed
US-6136822-A ETHER, HYDROXY QUINOLINONE COMPOUNDS DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-10-24 US disclosed
EP-0927718-A1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-07-07 EP disclosed