SCHEMBL25047342

SCHEMBL25047342

O[C@@H]1CCCC1n1ccc2cncnc21

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 4/20 0.39
WDR77 Q9BQA1 1/20 0.38
MKNK2 Q9HBH9 4/20 0.36
NNMT P40261 1/20 0.36
LCK P06239 1/20 0.36
SRC P12931 1/20 0.36
KDR P35968 1/20 0.36
TEK Q02763 1/20 0.36
IRAK4 Q9NWZ3 5/20 0.35
HCAR1 Q9BXC0 2/20 0.35
MKNK1 Q9BUB5 1/20 0.33
IDO1 P14902 1/20 0.33
TDO2 P48775 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
SCHEMBL5356546 0.78 AURKA (0.43) PRMT5WDR77MKNK2SRCKDR
SCHEMBL25047374 0.78 HCAR1 (0.34) LCKSRCKDRTEKHCAR1
SCHEMBL2241217 0.78 MKNK2 (0.41) PRMT5WDR77MKNK2SRCKDR
SCHEMBL25958441 0.77 AURKA (0.44) PRMT5WDR77MKNK2SRCKDR
SCHEMBL28122201 0.75 ABL1 (0.42) PRMT5WDR77MKNK2NNMTLCK
SCHEMBL24109809 0.74 NNMT (0.37) PRMT5WDR77MKNK2NNMTIRAK4
SCHEMBL29485663 0.73 ADK (0.45) PRMT5WDR77
SCHEMBL937901 0.73 UBA6 (0.49) PRMT5WDR77MKNK2NNMTIRAK4
SCHEMBL937900 0.73 MKNK2 (0.37) PRMT5WDR77MKNK2NNMTMKNK1
SCHEMBL25047326 0.72 ALDH1A1 (0.46) PRMT5WDR77MKNK2MKNK1

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-2023017152-A1 SPECIFIC SMALL MOLECULE INHIBITORS THAT BLOCK KMT9 METHYLTRANSFERASE ACTIVITY AND FUNCTION ALBERT-LUDWIGS-UNIVERSITÄT FREIBURG (DE) 2023-02-16 WO disclosed