SCHEMBL30812265

SCHEMBL30812265

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

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PDE4D Q08499 3/20 0.49
▸ PDE4B Q07343 3/20 0.49
▸ PDE4A P27815 2/20 0.49
▸ PDE4C Q08493 2/20 0.49
▸ PKM P14618 3/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ LMNA P02545 1/20 0.41
▸ GPR119 Q8TDV5 5/20 0.41
▸ TOP2A P11388 1/20 0.41
▸ STS P08842 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ UCHL1 P09936 1/20 0.40
▸ USP30 Q70CQ3 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.39

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
SCHEMBL30824791 0.89 PDE4D (0.48) PDE4DPDE4BPDE4APDE4CPKM
SCHEMBL30824880 0.87 PDE4D (0.46) PDE4DPDE4BPDE4APDE4CPKM
SCHEMBL27391578 0.87 PDE4D (0.46) PDE4DPDE4BPDE4APDE4CPKM
SCHEMBL30811962 0.87 PDE4D (0.51) PDE4DPDE4BPDE4APDE4CPKM
SCHEMBL30011780 0.84 PDE4B (0.52) PDE4DPDE4BPDE4APDE4CPKM
SCHEMBL18165158 0.84 PDE4B (0.52) PDE4DPDE4BPDE4APDE4CPKM
SCHEMBL29054073 0.84 PDE4B (0.52) PDE4DPDE4BPDE4APDE4CPKM
SCHEMBL30811946 0.82 PDE4D (0.47) PDE4DPDE4BPDE4APDE4CPKM
SCHEMBL30811958 0.80 PKM (0.44) PDE4DPDE4BPDE4APDE4CPKM
SCHEMBL31245970 0.79 PDE4D (0.42) PDE4DPDE4BPDE4APDE4CPKM

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-2024054956-A1 HETEROBIFUNCTIONAL COMPOUNDS AND METHODS OF TREATING DISEASE HALDA THERAPEUTICS OPCO, INC. (US) 2024-03-14 — — WO disclosed
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