SCHEMBL25047780

SCHEMBL25047780

Nc1ncnc2c1c(Br)cn2[C@@H]1C[C@H](CNCCCNCCc2ccc(F)cc2F)[C@@H](O)[C@H]1O

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ METTL3 Q86U44 18/20 0.51
▸ CA2 P00918 1/20 0.43
▸ PRMT5 O14744 1/20 0.40
▸ DOT1L Q8TEK3 1/20 0.40

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
SCHEMBL30941259 1.00 METTL3 (0.51) METTL3CA2PRMT5DOT1L
SCHEMBL25047779 0.91 METTL3 (0.50) METTL3CA2DOT1L
SCHEMBL30941571 0.91 METTL3 (0.50) METTL3CA2DOT1L
SCHEMBL31618086 0.90 METTL3 (0.59) METTL3CA2PRMT5DOT1L
SCHEMBL25047810 0.90 METTL3 (0.59) METTL3CA2PRMT5DOT1L
SCHEMBL25046820 0.90 CA2 (0.47) METTL3CA2PRMT5
SCHEMBL31618068 0.90 CA2 (0.47) METTL3CA2PRMT5
SCHEMBL25046614 0.88 METTL3 (0.59) METTL3CA2PRMT5
SCHEMBL31618042 0.88 METTL3 (0.59) METTL3CA2PRMT5
SCHEMBL25047860 0.86 METTL3 (0.60) METTL3CA2PRMT5DOT1L

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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