SCHEMBL7423009

SCHEMBL7423009

CCOC(=O)CNC(=O)c1ccc(OC)c(OC2CCCC2)c1

nearest known ligand 0.76

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 12/20 0.76
PDE4A P27815 10/20 0.76
PDE4B Q07343 10/20 0.76
PDE4C Q08493 10/20 0.76
EPHX2 P34913 3/20 0.64
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
PDE5A O76074 1/20 0.58
PDE1A P54750 1/20 0.58
PDE1B Q01064 1/20 0.58
PDE1C Q14123 1/20 0.58

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
SCHEMBL19083721 0.86 PDE4D (0.74) PDE4DPDE4APDE4BPDE4CEPHX2
SCHEMBL7477234 0.86 PDE4D (0.82) PDE4DPDE4APDE4BPDE4CEPHX2
SCHEMBL29802080 0.86 KMT2A (0.78) MEN1KMT2A
SCHEMBL15595269 0.86 KMT2A (0.78) MEN1KMT2A
SCHEMBL7458162 0.84 PDE4D (1.00) PDE4DPDE4APDE4BPDE4CEPHX2
SCHEMBL19075717 0.81 PDE4A (0.74) PDE4DPDE4APDE4BPDE4CEPHX2
SCHEMBL7424332 0.79 PDE4D (0.60) PDE4DPDE4APDE4BPDE4CEPHX2
SCHEMBL7423857 0.79 PDE4D (0.82) PDE4DPDE4APDE4BPDE4CEPHX2
SCHEMBL20589963 0.78 EPHX2 (1.00) PDE4DPDE4APDE4BPDE4CEPHX2
SCHEMBL7364116 0.78 PDE4B (0.56) PDE4DPDE4APDE4BPDE4CMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998056756-A1 CATECHOL AMINO ACID DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CHEIL JEDANG CORPORATION (KR) 1998-12-17 WO claimed
WO-1998056756-A1 CATECHOL AMINO ACID DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CHEIL JEDANG CORPORATION (KR) 1998-12-17 WO disclosed