SCHEMBL25077391

SCHEMBL25077391

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

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.36
▸ DOT1L Q8TEK3 3/20 0.33
▸ ACVRL1 P37023 1/20 0.32
▸ MAP4K4 O95819 1/20 0.31
▸ TNK2 Q07912 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
SCHEMBL25771797 0.84 POLRMT (0.37) POLRMTDOT1L
SCHEMBL23819093 0.83 POLRMT (0.40) POLRMTDOT1L
SCHEMBL26235249 0.83 POLRMT (0.37) POLRMTDOT1L
SCHEMBL26235537 0.83 POLRMT (0.36) POLRMTDOT1L
SCHEMBL26832526 0.82 POLRMT (0.35) POLRMTDOT1L
SCHEMBL25077083 0.81 POLRMT (0.35) POLRMTDOT1LACVRL1MAP4K4
SCHEMBL26235533 0.81 POLRMT (0.35) POLRMTDOT1L
SCHEMBL26235395 0.81 POLRMT (0.34) POLRMTDOT1L
SCHEMBL26235609 0.81 POLRMT (0.34) POLRMTDOT1L
SCHEMBL26235530 0.81 POLRMT (0.36) POLRMTDOT1LTNK2

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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