SCHEMBL7997587

SCHEMBL7997587

CC=C(CC)Oc1c(OC(C)C)c(=O)n(C)c2cc(N)ccc12

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.40
BRPF1 P55201 2/20 0.33
KDM4E B2RXH2 3/20 0.32
MAPT P10636 2/20 0.32
ALDH1A1 P00352 2/20 0.32
ALOX15 P16050 1/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
HSD17B10 Q99714 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
GAA P10253 1/20 0.30
GFER P55789 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
BRD4 O60885 1/20 0.30
TNF P01375 1/20 0.30

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
SCHEMBL7998916 0.88 KDM4E (0.37) TTRKDM4EMAPTALDH1A1HSD17B10
SCHEMBL8003956 0.88 TTR (0.42) TTRBRPF1KDM4EMAPTALDH1A1
SCHEMBL8000769 0.87 RORA (0.35) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7997828 0.86 KDM4E (0.45) TTRBRPF1KDM4EMAPTALDH1A1
SCHEMBL7988525 0.86 KDM4E (0.45) TTRBRPF1KDM4EMAPTALDH1A1
SCHEMBL7999661 0.86 TTR (0.40) TTRBRPF1KDM4EMAPTALDH1A1
SCHEMBL7997800 0.85 KDM4E (0.37) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL7999048 0.85 KDM4E (0.37) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL7998310 0.84 TTR (0.47) TTRBRPF1KDM4EMAPTALDH1A1
SCHEMBL7988874 0.84 TTR (0.39) TTRBRPF1KDM4EMAPTALDH1A1

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 3 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