SCHEMBL6579778

SCHEMBL6579778

C/C=C\c1ccc2c(c1)c(O)c(OC)c(=O)n2C

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.45
ALDH1A1 P00352 4/20 0.45
GAA P10253 2/20 0.45
TYR P14679 1/20 0.42
HPGD P15428 2/20 0.39
KDM1A O60341 1/20 0.38
TTR P02766 2/20 0.38
PADI4 Q9UM07 2/20 0.36
CNR2 P34972 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
TUBB1 Q9H4B7 1/20 0.35

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
SCHEMBL6579782 1.00 KDM4E (0.45) KDM4EALDH1A1GAATYRHPGD
SCHEMBL7975938 0.74 KDM4E (0.43) KDM4EALDH1A1GAAHPGDKDM1A
SCHEMBL7978025 0.74 ALDH1A1 (0.45) KDM4EALDH1A1GAAHPGDTP53
SCHEMBL5741498 0.74 KDM4E (0.74) KDM4EALDH1A1GAAHPGDKDM1A
SCHEMBL15219792 0.73 CNR2 (0.44) KDM4EALDH1A1TYRHPGDCNR2
SCHEMBL6579613 0.72 ALDH1A1 (0.51) KDM4EALDH1A1GAAHPGDKDM1A
SCHEMBL7980793 0.71 KDM4E (0.50) KDM4EALDH1A1GAAHPGDKDM1A
SCHEMBL6576851 0.70 TUBB4A (0.42) KDM4EALDH1A1GAAPOLBMAPT
SCHEMBL6577102 0.70 KDM4E (0.47) KDM4EALDH1A1HPGDCNR2MAPT
SCHEMBL6578821 0.70 TTR (0.49) KDM4EALDH1A1GAAHPGDKDM1A

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