SCHEMBL30824880

SCHEMBL30824880

COC(=O)c1ccc(OC2CC(N(C)CC3CCN(C(=O)OC(C)(C)C)CC3)C2)c(Br)c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PDE4D Q08499 3/20 0.46
▸ PDE4B Q07343 3/20 0.46
▸ PDE4A P27815 2/20 0.46
▸ PDE4C Q08493 2/20 0.46
▸ LIMK2 P53671 1/20 0.42
▸ GPR119 Q8TDV5 9/20 0.42
▸ PKM P14618 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ JAK2 O60674 1/20 0.40
▸ JAK1 P23458 1/20 0.40
▸ LMNA P02545 1/20 0.39
▸ TOP2A P11388 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
SCHEMBL27391578 1.00 PDE4D (0.46) PDE4DPDE4BPDE4APDE4CLIMK2
SCHEMBL30812265 0.87 PDE4D (0.49) PDE4DPDE4BPDE4APDE4CGPR119
SCHEMBL31245970 0.86 PDE4D (0.42) PDE4DPDE4BPDE4APDE4CGPR119
SCHEMBL30824791 0.85 PDE4D (0.48) PDE4DPDE4BPDE4APDE4CGPR119
SCHEMBL30811962 0.83 PDE4D (0.51) PDE4DPDE4BPDE4APDE4CGPR119
SCHEMBL30824739 0.82 NOTUM (0.37) PDE4DPDE4BPDE4APDE4C
SCHEMBL18165158 0.81 PDE4B (0.52) PDE4DPDE4BPDE4APDE4CGPR119
SCHEMBL30011780 0.81 PDE4B (0.52) PDE4DPDE4BPDE4APDE4CGPR119
SCHEMBL29054073 0.81 PDE4B (0.52) PDE4DPDE4BPDE4APDE4CGPR119
SCHEMBL30811946 0.78 PDE4D (0.47) PDE4DPDE4BPDE4APDE4CGPR119

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-2024054955-A1 HETEROBIFUNCTIONAL COMPOUNDS AND METHODS OF TREATING DISEASE HALDA THERAPEUTICS OPCO, INC. (US) 2024-03-14 — — WO disclosed
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