SCHEMBL7997675

SCHEMBL7997675

CCCCNc1ccc2c(OCC=C(C)C)c(OCC(C)CCC)c(=O)n(C)c2c1

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
ACHE P22303 1/20 0.31
CYP1B1 Q16678 1/20 0.31

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
SCHEMBL7999015 0.93 TDP1 (0.37) ALDH1A1
SCHEMBL7999022 0.93 TDP1 (0.37) ALDH1A1
SCHEMBL7997501 0.88 ALDH1A1 (0.34) ARALDH1A1LMNAACHECYP1B1
SCHEMBL7999110 0.88 AR (0.34) ARLMNA
SCHEMBL8002087 0.88 TP53 (0.33) ARALDH1A1LMNAACHECYP1B1
SCHEMBL7997246 0.87 AR (0.33) ARALDH1A1LMNAACHECYP1B1
SCHEMBL8000732 0.87 AR (0.33) ARALDH1A1LMNA
SCHEMBL7997493 0.86 MAPT (0.37) ARALDH1A1LMNAACHECYP1B1
SCHEMBL7998839 0.86 AR (0.34) ARALDH1A1LMNA
SCHEMBL7997676 0.85 AR (0.32) ARLMNA

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