SCHEMBL27358271

SCHEMBL27358271

C=C(C)O[C@@H]1CNC(=O)C1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 4/20 0.35
PDE4B Q07343 2/20 0.35
PDE4C Q08493 2/20 0.35
PDE4D Q08499 2/20 0.35
TSHR P16473 1/20 0.32

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
SCHEMBL18472040 0.82 POLB (0.34) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL3744381 0.82 POLB (0.34) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL21026696 0.82 POLB (0.34) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL27358272 0.81 PDE4A (0.33) PDE4APDE4BPDE4CPDE4D
SCHEMBL18009175 0.77 KEAP1 (0.30)
SCHEMBL31441632 0.76 ITGB1 (0.32) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL792893 0.76 ITGB1 (0.32) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL18009316 0.75 NFE2L2 (0.43) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL18009315 0.75 NFE2L2 (0.43) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL18009313 0.75 NFE2L2 (0.43) PDE4APDE4BPDE4CPDE4DTSHR

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-2024130344-A1 TRANSIENT RECEPTOR POTENTIAL VANILLOID 6 INHIBITORS UNIQUEST PTY LIMITED (AU) 2024-06-27 WO disclosed