SCHEMBL25047716

SCHEMBL25047716

CNc1ncnc2c1ccn2C1CCC(c2cn[nH]c2)C1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PIP4K2A P48426 1/20 0.42
YTHDC1 Q96MU7 1/20 0.39
PRMT5 O14744 8/20 0.37
WDR77 Q9BQA1 7/20 0.37
NAE1 Q13564 2/20 0.33
CA2 P00918 2/20 0.33
GRK5 P34947 1/20 0.33
CSNK1A1 P48729 1/20 0.33
UBA6 A0AVT1 1/20 0.33
NEDD8 Q15843 1/20 0.33
UBA3 Q8TBC4 1/20 0.33
SAE1 Q9UBE0 1/20 0.33
UBA2 Q9UBT2 1/20 0.33
PDPK1 O15530 1/20 0.33
CSF1R P07333 1/20 0.32
ACACB O00763 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 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
SCHEMBL25046760 0.84 PRMT5 (0.40) PRMT5WDR77
SCHEMBL25048154 0.84 PDE2A (0.36) PIP4K2AYTHDC1
SCHEMBL25047711 0.78 PRMT5 (0.45) PRMT5WDR77
SCHEMBL10293822 0.77 PIP4K2A (0.49) PIP4K2AYTHDC1PRMT5WDR77NAE1
SCHEMBL25048531 0.77 YTHDC1 (0.47) PIP4K2AYTHDC1PRMT5WDR77NAE1
SCHEMBL17875203 0.76 PRMT5 (0.47) PIP4K2AYTHDC1PRMT5WDR77NAE1
SCHEMBL23892256 0.73 PIP4K2A (0.43) PIP4K2AYTHDC1PRMT5WDR77NAE1
SCHEMBL25048059 0.72 CHKA (0.32)
SCHEMBL2740590 0.69 NAE1 (0.50) PIP4K2AYTHDC1PRMT5WDR77NAE1
SCHEMBL25047920 0.68 PIP4K2A (0.39) PIP4K2AYTHDC1PRMT5WDR77NAE1

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