SCHEMBL7988871

SCHEMBL7988871

CCCCOc1c(OCC=C(C)C)c2ccc(N)cc2n(C)c1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.39
ALDH1A1 P00352 6/20 0.36
MAPT P10636 3/20 0.36
KDM4E B2RXH2 3/20 0.36
GAA P10253 2/20 0.36
HPGD P15428 1/20 0.36
CYP1B1 Q16678 3/20 0.36
LMNA P02545 2/20 0.36
ACHE P22303 1/20 0.36
RXRA P19793 1/20 0.35
TNF P01375 2/20 0.33
PTPN1 P18031 1/20 0.33
ABCB1 P08183 2/20 0.33
CYP1A2 P05177 2/20 0.33
CYP1A1 P04798 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
MEN1 O00255 2/20 0.32
USP2 O75604 2/20 0.32
POLB P06746 2/20 0.32
KMT2A Q03164 2/20 0.32

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
SCHEMBL7998951 0.96 TTR (0.38) TTRALDH1A1MAPTKDM4EGAA
SCHEMBL8000914 0.96 TTR (0.38) TTRALDH1A1MAPTKDM4EGAA
SCHEMBL8001677 0.91 TDP1 (0.42) ALDH1A1MAPTKDM4EGAAHPGD
SCHEMBL8001078 0.91 TDP1 (0.42) ALDH1A1MAPTKDM4EGAAHPGD
SCHEMBL8001683 0.91 TDP1 (0.42) ALDH1A1MAPTKDM4EGAAHPGD
SCHEMBL8001083 0.91 TDP1 (0.42) ALDH1A1MAPTKDM4EGAAHPGD
SCHEMBL7999587 0.90 NPC1 (0.37) ALDH1A1MAPTKDM4EGAAHPGD
SCHEMBL7997723 0.89 TTR (0.44) TTRALDH1A1MAPTKDM4EGAA
SCHEMBL8001055 0.88 ALDH1A1 (0.36) ALDH1A1MAPTKDM4EGAAHPGD
SCHEMBL7988851 0.88 MAPT (0.39) MAPTKDM4EMEN1USP2POLB

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