SCHEMBL25077280

SCHEMBL25077280

C=N[C@]1(COP(=O)(O)OC[C@H](COCCCCCCCCCCCCCCCC)OCc2ccccc2)O[C@@H](c2ccc3c(N)ncnn23)[C@H](O)[C@@H]1O

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.51
▸ AKT1 P31749 5/20 0.32
▸ AKT2 P31751 4/20 0.32
▸ AKT3 Q9Y243 4/20 0.32
▸ PIK3R1 P27986 3/20 0.32
▸ PIK3CA P42336 3/20 0.32
▸ PLCG2 P16885 1/20 0.32
▸ GAB1 Q13480 1/20 0.32
▸ ADK P55263 1/20 0.31
▸ LPAR1 Q92633 2/20 0.31
▸ LPAR3 Q9UBY5 2/20 0.31
▸ 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
SCHEMBL25077245 0.91 POLRMT (0.45) POLRMTAKT1AKT2AKT3PIK3R1
SCHEMBL25764487 0.91 POLRMT (0.45) POLRMTAKT1AKT2AKT3PIK3R1
SCHEMBL25077274 0.89 POLRMT (0.50) POLRMTAKT1AKT2AKT3PIK3R1
SCHEMBL25076978 0.89 POLRMT (0.45) POLRMT
SCHEMBL26275953 0.88 POLRMT (0.43) POLRMTAKT1AKT2AKT3PIK3R1
SCHEMBL25077108 0.88 POLRMT (0.43) POLRMTAKT1AKT2AKT3PIK3R1
SCHEMBL25077637 0.86 POLRMT (0.45) POLRMT
SCHEMBL25077270 0.86 POLRMT (0.45) POLRMT
SCHEMBL25077236 0.85 POLRMT (0.45) POLRMTADKLPAR1LPAR3DOT1L
SCHEMBL25077133 0.85 POLRMT (0.48) 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-2023023527-A1 PHOSPHOLIPID COMPOUNDS AND METHODS OF MAKING AND USING THE SAME GILEAD SCIENCES, INC. (US) 2023-02-23 — — WO disclosed
Send feedback