SCHEMBL7992032

SCHEMBL7992032

CC=C(CC)Oc1c(OC(C)=O)c(=O)n(C)c2cc(NCc3ccccc3)ccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.43
ALDH1A1 P00352 5/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
MAOB P27338 1/20 0.37
SRC P12931 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
HPGD P15428 3/20 0.36
LMNA P02545 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
HSD17B3 P37058 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
BRD4 O60885 1/20 0.35
MAPT P10636 2/20 0.35
MITF O75030 1/20 0.35
ADORA2B P29275 1/20 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
SCHEMBL8001266 0.90 MAOB (0.38) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL8004054 0.89 MAOB (0.37) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7999670 0.88 MAOB (0.36) ALDH1A1SMN1; SMN2MEN1KMT2AMAOB
SCHEMBL7998991 0.87 ADRA2A (0.38) ALDH1A1SMN1; SMN2MEN1KMT2AMAOB
SCHEMBL7989247 0.84 MEN1 (0.47) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL8074644 0.84 KDM4E (0.41) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL8004374 0.82 TRPV1 (0.41) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL8004368 0.82 TRPV1 (0.41) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7997828 0.80 KDM4E (0.45) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7988525 0.80 KDM4E (0.45) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A

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