SCHEMBL30729409

SCHEMBL30729409

CC(C)(C)OC(=O)N1Cc2c(Cl)cnc(Br)c2C1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.36
NR1H2 P55055 2/20 0.33
NR1H3 Q13133 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
ELANE P08246 1/20 0.33
STK17B O94768 1/20 0.32
STK17A Q9UEE5 1/20 0.32
BUB1 O43683 1/20 0.32
F13A1 P00488 1/20 0.31
TGM2 P21980 1/20 0.31
TGM1 P22735 1/20 0.31
UCHL1 P09936 1/20 0.31
NPBWR1 P48145 1/20 0.31
MCHR1 Q99705 1/20 0.31
GPR119 Q8TDV5 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
ESR2 Q92731 1/20 0.30
GABRA1 P14867 2/20 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
SCHEMBL27075940 1.00 POLB (0.36) POLBNR1H2NR1H3HDAC1HDAC6
SCHEMBL29986081 0.81 POLB (0.38) POLBNR1H2NR1H3HDAC1HDAC6
SCHEMBL23089780 0.81 POLB (0.38) POLBNR1H2NR1H3HDAC1HDAC6
SCHEMBL27075952 0.81 POLB (0.38) POLBNR1H2NR1H3HDAC1HDAC6
SCHEMBL29736458 0.80 HDAC1 (0.36) POLBNR1H2HDAC1HDAC6BUB1
SCHEMBL23089773 0.80 HDAC1 (0.36) POLBNR1H2HDAC1HDAC6BUB1
SCHEMBL23090067 0.78 UCHL1 (0.36) POLBHDAC1HDAC6BUB1F13A1
SCHEMBL23114725 0.76 POLB (0.38) POLBNR1H2NR1H3HDAC1HDAC6
SCHEMBL31303368 0.75 BUB1 (0.36) POLBNR1H2NR1H3HDAC1HDAC6
SCHEMBL23090018 0.75 BUB1 (0.36) POLBNR1H2NR1H3HDAC1HDAC6

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
CN-117377673-A HPK1 antagonists and uses thereof 林伯士萨顿公司 2024-01-09 CN disclosed