SCHEMBL25048243

SCHEMBL25048243

CN(C)C(=O)[C@H]1C[C@@H](n2cc3c4c(ncnc42)NCCC3)[C@H](O)[C@@H]1O

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 2/20 0.35
▸ METTL3 Q86U44 1/20 0.35
▸ WDR77 Q9BQA1 1/20 0.35
▸ MTOR P42345 1/20 0.34
▸ RAB9A P51151 1/20 0.34

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
SCHEMBL30941327 1.00 PRMT5 (0.35) PRMT5METTL3WDR77MTORRAB9A
SCHEMBL30941391 0.86 PRMT5 (0.40) PRMT5METTL3WDR77MTORRAB9A
SCHEMBL25046728 0.86 PRMT5 (0.40) PRMT5METTL3WDR77MTORRAB9A
SCHEMBL31617907 0.83 — —
SCHEMBL25047680 0.83 — —
SCHEMBL25047681 0.80 ADCY5 (0.33) —
SCHEMBL30940836 0.77 MTOR (0.35) PRMT5METTL3WDR77MTORRAB9A
SCHEMBL25046679 0.77 MTOR (0.35) PRMT5METTL3WDR77MTORRAB9A
SCHEMBL25048504 0.76 METTL3 (0.38) PRMT5METTL3WDR77MTORRAB9A
SCHEMBL30941135 0.76 METTL3 (0.38) PRMT5METTL3WDR77MTORRAB9A

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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