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SCHEMBL25077051

SCHEMBL25077051

CCCCCCCCCCCCCCCCCCOCC(COP(=O)(O)OC[C@@]1(C)O[C@@H](c2ccc3c(N)ncnn23)[C@H](O)[C@@H]1O)OCc1ccc(C#N)cn1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.41
▸ AKT1 P31749 3/20 0.31
▸ PIK3R1 P27986 2/20 0.31
▸ AKT2 P31751 2/20 0.31
▸ PIK3CA P42336 2/20 0.31
▸ AKT3 Q9Y243 2/20 0.31
▸ PLCG2 P16885 1/20 0.31
▸ GAB1 Q13480 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
SCHEMBL25764794 1.00 POLRMT (0.41) POLRMTAKT1PIK3R1AKT2PIK3CA
SCHEMBL25076981 0.93 POLRMT (0.42) POLRMTAKT1PIK3R1AKT2PIK3CA
SCHEMBL25762072 0.92 POLRMT (0.41) POLRMT
SCHEMBL25764867 0.92 POLRMT (0.41) POLRMTAKT1PIK3R1AKT2PIK3CA
SCHEMBL25077336 0.92 POLRMT (0.41) POLRMT
SCHEMBL25077262 0.92 POLRMT (0.41) POLRMTAKT1PIK3R1AKT2PIK3CA
SCHEMBL25783920 0.91 POLRMT (0.43) POLRMTAKT1PIK3R1AKT2PIK3CA
SCHEMBL25077155 0.91 POLRMT (0.43) POLRMTAKT1PIK3R1AKT2PIK3CA
SCHEMBL25771301 0.91 POLRMT (0.35) POLRMTAKT1PIK3R1AKT2PIK3CA
SCHEMBL25077533 0.90 POLRMT (0.39) POLRMTAKT1PIK3R1AKT2PIK3CA

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-2023023527-A1 PHOSPHOLIPID COMPOUNDS AND METHODS OF MAKING AND USING THE SAME GILEAD SCIENCES, INC. (US) 2023-02-23 — — WO disclosed
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