SCHEMBL22325916

SCHEMBL22325916

Brc1ccc2cc[nH]c2c1Oc1ccccc1.CC(=O)c1c[nH]c2c(Oc3ccccc3)c(Br)ccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRPF1 P55201 1/20 0.42
KEAP1 Q14145 1/20 0.36
PBRM1 Q86U86 1/20 0.36
CSNK2A2 P19784 1/20 0.35
CSNK2B P67870 1/20 0.35
CSNK2A1 P68400 1/20 0.35
RHEB Q15382 2/20 0.33
PDPK1 O15530 1/20 0.33
NR4A2 P43354 3/20 0.33
DHODH Q02127 1/20 0.32
HTR2C P28335 1/20 0.32
BRD4 O60885 2/20 0.32
BCHE P06276 1/20 0.32
IKBKB O14920 1/20 0.32
CHUK O15111 1/20 0.32
POLB P06746 1/20 0.31
ALOX15 P16050 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 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
SCHEMBL22325829 0.81 RHEB (0.43) BRPF1KEAP1RHEBPDPK1BRD4
SCHEMBL22326019 0.70 PIN1 (0.35) KEAP1RHEBBRD4POLBKDM4E
SCHEMBL22325794 0.68 BRD4 (0.42) BRPF1BRD4
SCHEMBL22326064 0.67 BRD4 (0.52) BRPF1PBRM1BRD4
SCHEMBL32677627 0.66 BRPF1 (0.51) BRPF1PBRM1CSNK2A2CSNK2BCSNK2A1
SCHEMBL3790885 0.64 KEAP1 (0.70) BRPF1KEAP1PDPK1BCHEIKBKB
SCHEMBL30690400 0.64 KEAP1 (0.70) BRPF1KEAP1PDPK1BCHEIKBKB
SCHEMBL2305754 0.64 BRD4 (0.41) BRPF1HTR2CBRD4POLB
Acetic Acid SCHEMBL27953390 0.61 KEAP1 (0.56) KEAP1PDPK1BCHEIKBKBCHUK
SCHEMBL31522091 0.61 NR1H4 (0.38) DHODHPOLBALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020162471-A1 PYRIDONE DERIVATIVE マルホ株式会社 2020-08-13 WO disclosed