SCHEMBL25048514

SCHEMBL25048514

C=C/C(=C\C)CCNCCCNC[C@H]1C[C@@H](n2cc(CC)c3c(N)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ METTL3 Q86U44 13/20 0.44
▸ CA2 P00918 2/20 0.40
▸ AHCY P23526 2/20 0.39
▸ MTOR P42345 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ PRMT5 O14744 1/20 0.37
▸ ADORA2B P29275 1/20 0.36
▸ DOT1L Q8TEK3 1/20 0.35
▸ HNMT P50135 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
SCHEMBL25048822 0.82 METTL3 (0.49) METTL3CA2AHCYPRMT5
SCHEMBL31618064 0.82 METTL3 (0.49) METTL3CA2AHCYPRMT5
SCHEMBL30941392 0.82 METTL3 (0.49) METTL3CA2AHCYPRMT5
SCHEMBL31618069 0.82 METTL3 (0.50) METTL3CA2AHCYMTORRAB9A
SCHEMBL25048766 0.82 METTL3 (0.50) METTL3CA2AHCYMTORRAB9A
SCHEMBL25046820 0.80 CA2 (0.47) METTL3CA2AHCYMTORRAB9A
SCHEMBL31618068 0.80 CA2 (0.47) METTL3CA2AHCYMTORRAB9A
SCHEMBL25048001 0.79 METTL3 (0.34) METTL3CA2AHCYMTORRAB9A
SCHEMBL25047460 0.79 METTL3 (0.48) METTL3CA2AHCYPRMT5DOT1L
SCHEMBL31618109 0.79 METTL3 (0.48) METTL3CA2AHCYPRMT5DOT1L

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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