SCHEMBL26237143

SCHEMBL26237143

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

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.33
▸ RIPK1 Q13546 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ GLA P06280 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ CASP1 P29466 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ CASP7 P55210 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ HSD17B10 Q99714 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) POLRMT
SCHEMBL26237759 0.89 POLRMT (0.33) POLRMTHTT
SCHEMBL26240401 0.89 POLRMT (0.33) POLRMT
SCHEMBL26237954 0.88 POLRMT (0.33) POLRMT
SCHEMBL26240281 0.87 POLRMT (0.33) POLRMT
SCHEMBL26238101 0.87 POLRMT (0.34) POLRMT
SCHEMBL26237826 0.86 POLRMT (0.35) POLRMT
SCHEMBL26240249 0.85 POLRMT (0.34) POLRMT
SCHEMBL26237975 0.85 TNK2 (0.35) POLRMTRIPK1ALDH1A1GAAHSD17B10
SCHEMBL26237462 0.85 POLRMT (0.34) POLRMT

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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