SCHEMBL7999322

SCHEMBL7999322

CCCCn1c(=O)c(O)c(OCC=C(C)C)c2ccc(N)cc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.38
KDM4E B2RXH2 4/20 0.38
LMNA P02545 3/20 0.38
HPGD P15428 2/20 0.38
TYMS P04818 1/20 0.37
TTR P02766 2/20 0.36
NPC1 O15118 2/20 0.36
POLB P06746 2/20 0.36
MEN1 O00255 1/20 0.36
RGS12 O14924 1/20 0.36
USP2 O75604 1/20 0.36
RAB9A P51151 1/20 0.36
BLM P54132 1/20 0.36
CACNA1B Q00975 1/20 0.36
APBA1 Q02410 1/20 0.36
KMT2A Q03164 1/20 0.36
KEAP1 Q14145 1/20 0.36
NFE2L2 Q16236 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CNR2 P34972 2/20 0.35

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
SCHEMBL8001122 0.96 TYMS (0.40) ALDH1A1KDM4ELMNAHPGDTYMS
SCHEMBL7988429 0.96 TYMS (0.40) ALDH1A1KDM4ELMNAHPGDTYMS
SCHEMBL8001869 0.92 TDP1 (0.42) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL8001871 0.92 TDP1 (0.42) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL7998773 0.89 SRC (0.39) ALDH1A1KDM4ELMNAHPGDTTR
SCHEMBL7999587 0.89 NPC1 (0.37) ALDH1A1KDM4ELMNAHPGDNPC1
SCHEMBL8001105 0.89 CYP1B1 (0.38) ALDH1A1KDM4ELMNANPC1POLB
SCHEMBL8001270 0.88 TDP1 (0.41) ALDH1A1KDM4EHPGDTYMSMEN1
SCHEMBL8001027 0.88 TDP1 (0.41) ALDH1A1KDM4EHPGDTYMSMEN1
SCHEMBL8001034 0.88 TDP1 (0.41) ALDH1A1KDM4EHPGDTYMSMEN1

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