SCHEMBL7998977

SCHEMBL7998977

CCCCCCOc1c(OC(C)=O)c(=O)n(C)c2cc(NC(=O)c3ccccc3)ccc12

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.46
NR1H4 Q96RI1 4/20 0.46
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MAPT P10636 2/20 0.41
POLB P06746 1/20 0.41
SRC P12931 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
PPARA Q07869 1/20 0.41
GPR35 Q9HC97 1/20 0.41
THRB P10828 1/20 0.40
NTRK1 P04629 1/20 0.40
NGFR P08138 1/20 0.40
HPGD P15428 1/20 0.40
RECQL P46063 1/20 0.40

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
SCHEMBL7997469 0.93 NR1H4 (0.52) TP53NR1H4MAPTPOLBMEN1
SCHEMBL8066615 0.89 NR1H4 (0.45) NR1H4MAPTMEN1KMT2A
SCHEMBL7988822 0.89 TP53 (0.48) TP53NR1H4KDM4EALDH1A1SMN1; SMN2
SCHEMBL6579536 0.88 NR1H4 (0.48) TP53NR1H4KDM4EALDH1A1SMN1; SMN2
SCHEMBL7998813 0.84 NR1H4 (0.48) NR1H4MAPTMEN1KMT2A
SCHEMBL8001209 0.84 NR1H4 (0.50) TP53NR1H4KDM4EALDH1A1SMN1; SMN2
SCHEMBL7997564 0.84 TP53 (0.50) TP53NR1H4ALDH1A1SMN1; SMN2MAPT
SCHEMBL7998846 0.83 NR1H4 (0.50) NR1H4MAPTMEN1KMT2A
SCHEMBL7988572 0.83 MAPT (0.47) MAPTMEN1KMT2A
SCHEMBL7998030 0.81 TP53 (0.41) TP53NR1H4KDM4EALDH1A1MAPT

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