SCHEMBL27589079

SCHEMBL27589079

CCCC(=O)OC1CCN(C(=O)OC(C)(C)C)CC1F

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.42
▸ RECQL P46063 1/20 0.40
▸ DPP4 P27487 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ PDE4D Q08499 3/20 0.39
▸ PDE4A P27815 2/20 0.39
▸ PDE4B Q07343 2/20 0.39
▸ PDE4C Q08493 2/20 0.39
▸ EPHX1 P07099 1/20 0.38
▸ NR1H2 P55055 1/20 0.37
▸ PIK3CD O00329 1/20 0.37
▸ GPR119 Q8TDV5 4/20 0.36
▸ JAK2 O60674 1/20 0.36
▸ JAK1 P23458 1/20 0.36

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
SCHEMBL19015182 0.85 HPGD (0.44) HPGDRECQLDPP4MEN1ALDH1A1
SCHEMBL29206701 0.80 HPGD (0.49) HPGDRECQLDPP4MEN1ALDH1A1
SCHEMBL20970529 0.80 HPGD (0.49) HPGDRECQLDPP4MEN1ALDH1A1
SCHEMBL29214583 0.80 HPGD (0.49) HPGDRECQLDPP4MEN1ALDH1A1
SCHEMBL19015480 0.80 HPGD (0.49) HPGDRECQLDPP4MEN1ALDH1A1
SCHEMBL23579480 0.80 HPGD (0.49) HPGDRECQLDPP4MEN1ALDH1A1
SCHEMBL15740593 0.80 HPGD (0.49) HPGDRECQLDPP4MEN1ALDH1A1
SCHEMBL16374503 0.80 HPGD (0.49) HPGDRECQLDPP4MEN1ALDH1A1
SCHEMBL15742958 0.80 HPGD (0.49) HPGDRECQLDPP4MEN1ALDH1A1
SCHEMBL27491784 0.79 PDE4D (0.51) HPGDRECQLDPP4MAPTPDE4D

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
CN-1391473-A VLA-4 inhibitor compounds DAIICHI SEIYAKU CO (JP) 2003-01-15 — — CN disclosed
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