SCHEMBL8001085

SCHEMBL8001085

C=CCOc1c(OCC=C(C)C)c2ccc(N)cc2n(CCCC)c1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.35
ALDH1A1 P00352 4/20 0.35
POLB P06746 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
PGR P06401 4/20 0.35
NPC1 O15118 4/20 0.34
RGS12 O14924 1/20 0.34
USP2 O75604 1/20 0.34
RAB9A P51151 1/20 0.34
BLM P54132 1/20 0.34
CACNA1B Q00975 1/20 0.34
APBA1 Q02410 1/20 0.34
KEAP1 Q14145 1/20 0.34
NFE2L2 Q16236 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
RORA P35398 4/20 0.34
RORC P51449 4/20 0.34
RORB Q92753 4/20 0.34
LMNA P02545 1/20 0.34

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
SCHEMBL7990382 0.96 KDM4E (0.37) KDM4EALDH1A1POLBMEN1KMT2A
SCHEMBL8005702 0.96 KDM4E (0.37) KDM4EALDH1A1POLBMEN1KMT2A
SCHEMBL7999587 0.92 NPC1 (0.37) KDM4EALDH1A1POLBMEN1KMT2A
SCHEMBL7999699 0.92 TDP1 (0.40) KDM4EALDH1A1MEN1KMT2AMAPK1
SCHEMBL7999703 0.92 TDP1 (0.40) KDM4EALDH1A1MEN1KMT2AMAPK1
SCHEMBL8002113 0.90 MEN1 (0.37) KDM4EALDH1A1POLBMEN1KMT2A
SCHEMBL7997305 0.90 MEN1 (0.37) KDM4EALDH1A1POLBMEN1KMT2A
SCHEMBL8001105 0.90 CYP1B1 (0.38) KDM4EALDH1A1POLBMEN1KMT2A
SCHEMBL7999009 0.90 KDM4E (0.41) KDM4EALDH1A1POLBMEN1KMT2A
SCHEMBL7998554 0.90 POLB (0.39) KDM4EALDH1A1POLBMEN1KMT2A

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