SCHEMBL7999664

SCHEMBL7999664

CC(C)=CCOc1c(OC(C)C)c(=O)n(C)c2cc(NCc3ccccc3)ccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.36
CASR P41180 1/20 0.35
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
CYP1A2 P05177 1/20 0.34
POLB P06746 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ADRA2A P08913 1/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 2/20 0.34
ADORA2B P29275 2/20 0.34
ADORA1 P30542 1/20 0.34
IP6K1 Q92551 1/20 0.33
ADORA2A P29274 1/20 0.33
FFAR1 O14842 1/20 0.33
BRPF1 P55201 1/20 0.33
GABRP O00591 1/20 0.33

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
SCHEMBL8474606 0.93 ADRA2A (0.35) MAOBCASRMEN1KMT2APOLB
SCHEMBL8001337 0.93 ALOX15 (0.38) MEN1KMT2ACYP2D6CYP2C9CYP2C19
SCHEMBL8001330 0.93 ALOX15 (0.38) MEN1KMT2ACYP2D6CYP2C9CYP2C19
SCHEMBL7988986 0.90 MAOB (0.38) MAOBMEN1KMT2ACYP1A2POLB
SCHEMBL8004050 0.88 MAOB (0.36) MAOBMEN1KMT2ACYP1A2CYP2C9
SCHEMBL8074644 0.88 KDM4E (0.41) MAOBMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL7998987 0.86 ADRA2A (0.38) MAOBMEN1KMT2APOLBSMN1; SMN2
SCHEMBL7998972 0.85 MAOB (0.41) MAOBCASRMEN1KMT2ACYP1A2
SCHEMBL8002087 0.84 TP53 (0.33) MEN1KMT2ASMN1; SMN2ALDH1A1HPGD
SCHEMBL8002068 0.84 ADRA2A (0.40) MAOBCASRMEN1KMT2ACYP1A2

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
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