SCHEMBL25047424

SCHEMBL25047424

CNc1ncnc2c1c(C)cn2[C@@H]1O[C@H](CN)[C@H]2OC(C)(C)O[C@H]21

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 9/20 0.45
▸ PI4KA P42356 1/20 0.45
▸ PI4K2B Q8TCG2 1/20 0.45
▸ PI4K2A Q9BTU6 1/20 0.45
▸ PI4KB Q9UBF8 1/20 0.45
▸ PRMT5 O14744 4/20 0.40
▸ WDR77 Q9BQA1 1/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.40
▸ METTL3 Q86U44 2/20 0.38
▸ P2RX1 P51575 1/20 0.37
▸ P2RX3 P56373 1/20 0.37
▸ P2RX4 Q99571 1/20 0.37
▸ AMD1 P17707 2/20 0.36

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
SCHEMBL25047401 0.90 ADK (0.54) ADKPI4KAPI4K2BPI4K2API4KB
SCHEMBL18297471 0.77 ADK (0.65) ADKPI4KAPI4K2BPI4K2API4KB
SCHEMBL16120510 0.77 ADK (0.65) ADKPI4KAPI4K2BPI4K2API4KB
SCHEMBL18572215 0.75 PI4KA (0.56) ADKPI4KAPI4K2BPI4K2API4KB
SCHEMBL25047763 0.75 PI4KA (0.40) ADKPI4KAPI4K2BPI4K2API4KB
Trifluoroacetic Acid SCHEMBL30941138 0.74 ADK (0.55) ADKPRMT5WDR77METTL3
SCHEMBL23121197 0.73 PI4KA (0.59) PI4KAPI4K2BPI4K2API4KBPRMT5
SCHEMBL18297604 0.73 ADK (0.62) ADKPI4KAPI4K2BPI4K2API4KB
SCHEMBL17816344 0.73 ADK (0.78) ADK
SCHEMBL20133912 0.73 PI4KA (0.65) PI4KAPI4K2BPI4K2API4KBRXFP1

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
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