SCHEMBL25077083

SCHEMBL25077083

N#C[C@@]1(CO)CC[C@H](c2ccc3c(N)ncnn23)O1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.35
▸ ACVRL1 P37023 2/20 0.33
▸ MAP4K4 O95819 1/20 0.32
▸ TMPRSS2 O15393 1/20 0.31
▸ PIK3CD O00329 5/20 0.31
▸ DOT1L Q8TEK3 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
SCHEMBL23818812 0.84 POLRMT (0.39) POLRMT
SCHEMBL26239790 0.82 POLRMT (0.35) POLRMTMAP4K4DOT1L
SCHEMBL26237826 0.82 POLRMT (0.35) POLRMT
SCHEMBL26238101 0.82 POLRMT (0.34) POLRMT
SCHEMBL25077391 0.81 POLRMT (0.36) POLRMTACVRL1MAP4K4DOT1L
SCHEMBL26232641 0.81 POLRMT (0.34) POLRMTDOT1L
SCHEMBL26237462 0.81 POLRMT (0.34) POLRMT
SCHEMBL26237178 0.81 POLRMT (0.34) POLRMT
SCHEMBL21120428 0.80 POLRMT (0.56) POLRMT
SCHEMBL26239686 0.80 POLRMT (0.34) POLRMTPIK3CD

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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