SCHEMBL20006105

SCHEMBL20006105

CN(C(=O)OC(C)(C)C)c1cnc2ccc(Br)cc2c1N(C=O)C1CCOCC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 2/20 0.35
RXFP1 Q9HBX9 3/20 0.33
AAK1 Q2M2I8 1/20 0.33
HTT P42858 2/20 0.32
TSHR P16473 1/20 0.32
ABL1 P00519 1/20 0.32
PDE4B Q07343 1/20 0.32
ALDH1A1 P00352 2/20 0.32
IRAK4 Q9NWZ3 2/20 0.32
USP2 O75604 1/20 0.31
SCN9A Q15858 1/20 0.31
SLC2A1 P11166 1/20 0.31
SLC2A2 P11168 1/20 0.31
SLC2A3 P11169 1/20 0.31
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 1/20 0.31
RAF1 P04049 1/20 0.30
BRAF P15056 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL21512512 0.76 HTT (0.41) MALT1RXFP1AAK1HTTTSHR
SCHEMBL29969729 0.76 HTT (0.41) MALT1RXFP1AAK1HTTTSHR
SCHEMBL29968478 0.73 HTT (0.39) MALT1RXFP1AAK1HTTTSHR
SCHEMBL21512507 0.73 HTT (0.39) MALT1RXFP1AAK1HTTTSHR
SCHEMBL20006099 0.72 IRAK4 (0.37) RXFP1AAK1HTTABL1IRAK4
SCHEMBL28537583 0.71 MAPK1 (0.35) RXFP1HTTTSHRALDH1A1USP2
SCHEMBL18843813 0.68 RXFP1 (0.38) MALT1RXFP1HTTTSHRALDH1A1
SCHEMBL21561046 0.66 MALT1 (0.39) MALT1RXFP1AAK1HTTTSHR
SCHEMBL21512626 0.66 MAPK1 (0.37) RXFP1HTTTSHRALDH1A1KMT2A
SCHEMBL19003377 0.64 AAK1 (0.41) AAK1ALDH1A1

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
EP-3140303-B1 IMIDAZO[4,5-C]QUINOLIN-2-ONE COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2018-03-28 EP disclosed