SCHEMBL24791261

SCHEMBL24791261

Nc1ncnn2c(C3CCC(COC(=O)CC4CCCCC4)O3)ccc12

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MIF P14174 1/20 0.34
▸ DOT1L Q8TEK3 2/20 0.32
▸ POLRMT O00411 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL27122220 0.90 DOT1L (0.34) DOT1LPOLRMT
SCHEMBL24791279 0.87 L3MBTL1 (0.34) MIFALDH1A1HPGDMAPK1L3MBTL1
SCHEMBL25723098 0.87 DOT1L (0.33) DOT1LPOLRMTALDH1A1HPGD
SCHEMBL24606280 0.87 DOT1L (0.35) DOT1LPOLRMT
SCHEMBL27121538 0.85 TNK2 (0.38) DOT1LPOLRMT
SCHEMBL27121214 0.85 DOT1L (0.34) DOT1L
SCHEMBL24606310 0.84 DOT1L (0.36) DOT1LPOLRMT
SCHEMBL24606256 0.84 DOT1L (0.34) DOT1LPOLRMT
SCHEMBL25915184 0.84 DOT1L (0.34) MIFDOT1LPOLRMTALDH1A1HPGD
SCHEMBL24606327 0.84 DOT1L (0.34) DOT1LPOLRMT

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-2022265964-A1 ORALLY-BIOAVAILABLE NUCLEOSIDE ANALOGS VenatoRx Pharmaceuticals, Inc. (US) 2022-12-22 — — WO disclosed
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