SCHEMBL17583233

SCHEMBL17583233

CC(=CC1CC[C@]2(C)C3CC[C@]4(C)[C@@H]([C@H](C)CCCC(C)C)CC[C@@]4(C)C3CCC2C1(C)C)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CDC25A P30304 9/20 0.43
▸ CDC25B P30305 5/20 0.43
▸ EBP Q15125 5/20 0.42
▸ ACLY P53396 1/20 0.42
▸ ACACA Q13085 1/20 0.42
▸ HMGCR P04035 1/20 0.41
▸ FNTA P49354 2/20 0.39
▸ FNTB P49356 2/20 0.39
▸ NPC1L1 Q9UHC9 1/20 0.38

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
SCHEMBL17583234 0.87 EBP (0.43) CDC25ACDC25BEBPACLYACACA
SCHEMBL28831684 0.80 HMGCR (0.54) CDC25ACDC25BEBPACLYACACA
SCHEMBL29527487 0.74 CDC25A (0.51) CDC25ACDC25BEBPNPC1L1
SCHEMBL29410405 0.74 CDC25A (0.51) CDC25ACDC25BEBPNPC1L1
SCHEMBL29398347 0.74 CDC25A (0.51) CDC25ACDC25BEBPNPC1L1
SCHEMBL332666 0.74 CDC25A (0.51) CDC25ACDC25BEBPNPC1L1
SCHEMBL17710345 0.74 CETP (0.44) CDC25ACDC25BEBPHMGCRFNTA
SCHEMBL9766747 0.73 HMGCR (0.49) CDC25ACDC25BEBPACLYACACA
SCHEMBL9766753 0.73 HMGCR (0.49) CDC25ACDC25BEBPACLYACACA
SCHEMBL1470722 0.73 EBP (0.48) CDC25ACDC25BEBPHMGCRNPC1L1

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
US-20160079007-A1 BINDER COMPOSITION FOR POWER STORAGE DEVICES JSR CORPORATION (JP) 2016-03-17 — — US disclosed
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