SCHEMBL25048329

SCHEMBL25048329

CNc1ncnc2c1ccn2C1CCC(CNCCCNCCc2cccc(CCc3ccccc3)c2)C1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 12/20 0.40
▸ WDR77 Q9BQA1 7/20 0.38
▸ PIP4K2A P48426 1/20 0.35
▸ METTL3 Q86U44 2/20 0.35
▸ IGF1R P08069 1/20 0.34
▸ METTL14 Q9HCE5 1/20 0.34
▸ KCNK2 O95069 1/20 0.34
▸ JAK2 O60674 1/20 0.33
▸ JAK1 P23458 1/20 0.33
▸ TYK2 P29597 1/20 0.33
▸ JAK3 P52333 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ ABL1 P00519 1/20 0.33
▸ EGFR P00533 1/20 0.33
▸ ABL2 P42684 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
SCHEMBL25048728 0.97 PRMT5 (0.39) PRMT5WDR77PIP4K2AMETTL3JAK2
SCHEMBL25048261 0.92 IGF1R (0.36) PRMT5WDR77PIP4K2AMETTL3IGF1R
SCHEMBL25046638 0.92 PRMT5 (0.38) PRMT5WDR77PIP4K2AMETTL3IGF1R
SCHEMBL25048325 0.92 PRMT5 (0.37) PRMT5WDR77PIP4K2AMETTL3IGF1R
SCHEMBL25047713 0.90 PRMT5 (0.41) PRMT5WDR77PIP4K2AMETTL3
SCHEMBL25048328 0.84 PRMT5 (0.55) PRMT5WDR77METTL3
SCHEMBL31618052 0.84 PRMT5 (0.55) PRMT5WDR77METTL3
SCHEMBL25048878 0.84 EPHX2 (0.38) PRMT5IGF1R
SCHEMBL25047759 0.82 PRMT5 (0.40) PRMT5WDR77PIP4K2AMETTL3
SCHEMBL25047776 0.81 PRMT5 (0.54) PRMT5WDR77METTL3

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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