SCHEMBL26240401

SCHEMBL26240401

CC(C)(C)CCOC(=O)OC[C@]1(C#N)CCC(c2ccc3c(N)ncnn23)O1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.33
▸ AXL P30530 2/20 0.32
▸ DOT1L Q8TEK3 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
SCHEMBL26239790 0.89 POLRMT (0.35) POLRMTDOT1L
SCHEMBL26237759 0.89 POLRMT (0.33) POLRMTDOT1L
SCHEMBL26237143 0.89 POLRMT (0.33) POLRMT
SCHEMBL26232641 0.88 POLRMT (0.34) POLRMTAXLDOT1L
SCHEMBL26238101 0.87 POLRMT (0.34) POLRMTAXL
SCHEMBL26235609 0.87 POLRMT (0.34) POLRMTDOT1L
SCHEMBL26237826 0.86 POLRMT (0.35) POLRMT
SCHEMBL26240281 0.86 POLRMT (0.33) POLRMTAXL
SCHEMBL26240249 0.85 POLRMT (0.34) POLRMTAXL
SCHEMBL26237975 0.85 TNK2 (0.35) POLRMTDOT1L

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-2023168254-A1 ANTIVIRAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME GILEAD SCIENCES, INC. (US) 2023-09-07 — — WO disclosed
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