SCHEMBL24148935

SCHEMBL24148935

CCCOC(=O)CNP(OCC1CCC(c2ccc3c(N)ncnn23)O1)Oc1ccc(C(C)(C)C)cc1

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ DOT1L Q8TEK3 3/20 0.38
▸ GRM2 Q14416 1/20 0.30

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
SCHEMBL24149833 0.91 DOT1L (0.36) DOT1L
SCHEMBL24149666 0.90 DOT1L (0.39) DOT1LGRM2
SCHEMBL24149617 0.88 DOT1L (0.36) DOT1L
SCHEMBL24149850 0.88 DOT1L (0.36) DOT1L
SCHEMBL24148995 0.84 — —
SCHEMBL24158150 0.83 DOT1L (0.33) DOT1L
SCHEMBL24149846 0.82 DOT1L (0.37) DOT1L
SCHEMBL24058189 0.82 DOT1L (0.33) DOT1L
SCHEMBL24057868 0.81 DOT1L (0.34) DOT1L
SCHEMBL24149020 0.79 DOT1L (0.37) DOT1LGRM2

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-2021262826-A2 1'-CYANO NUCLEOSIDE ANALOGS AND USES THEREOF GILEAD SCIENCES, INC. (US) 2021-12-30 — — WO disclosed
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