SCHEMBL26235249

SCHEMBL26235249

COC(=O)OC[C@]1(C)CC[C@H](c2ccc3c(N)ncnn23)O1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.37
▸ DOT1L Q8TEK3 3/20 0.34
▸ RIPK1 Q13546 5/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ PIK3CD O00329 1/20 0.31
▸ CSNK2A2 P19784 3/20 0.31
▸ CSNK2A1 P68400 3/20 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
SCHEMBL26832526 0.91 POLRMT (0.35) POLRMTDOT1LRIPK1
SCHEMBL26235338 0.90 POLRMT (0.35) POLRMTDOT1L
SCHEMBL26235537 0.90 POLRMT (0.36) POLRMTDOT1L
SCHEMBL26235390 0.89 POLRMT (0.35) POLRMTDOT1L
SCHEMBL26235392 0.88 POLRMT (0.35) POLRMTDOT1L
SCHEMBL26235533 0.88 POLRMT (0.35) POLRMTDOT1L
SCHEMBL26235613 0.88 POLRMT (0.36) POLRMTDOT1LRIPK1
SCHEMBL26235397 0.88 POLRMT (0.35) POLRMTDOT1L
SCHEMBL26235336 0.88 POLRMT (0.34) POLRMTDOT1LPIK3CDCSNK2A2CSNK2A1
SCHEMBL26235530 0.88 POLRMT (0.36) POLRMTDOT1LRIPK1SMN1; SMN2

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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