SCHEMBL7207672

SCHEMBL7207672

CC(C)c1[c]c(C(C)C)cc(C(=O)CC2CCCCC2)c1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 3/20 0.46
PDE4B Q07343 3/20 0.46
PDE4C Q08493 3/20 0.46
PDE4D Q08499 3/20 0.46
NPC1 O15118 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
POLB P06746 2/20 0.36
EPHX2 P34913 3/20 0.35
EPHX1 P07099 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL7207668 0.74 PDE4A (0.37) PDE4APDE4BPDE4CPDE4DEPHX2
SCHEMBL17041598 0.72 PDE4A (0.51) PDE4APDE4BPDE4CPDE4DNPC1
SCHEMBL27557452 0.69 PDE4A (0.48) PDE4APDE4BPDE4CPDE4DNPC1
SCHEMBL2437519 0.69 NPC1 (0.51) PDE4APDE4BPDE4CPDE4DNPC1
SCHEMBL2439507 0.69 NPC1 (0.51) PDE4APDE4BPDE4CPDE4DNPC1
SCHEMBL2438485 0.68 EPHX2 (0.57) PDE4APDE4BPDE4CPDE4DNPC1
SCHEMBL1278317 0.68 EPHX2 (0.57) PDE4APDE4BPDE4CPDE4DNPC1
SCHEMBL28595923 0.68 EPHX2 (0.57) PDE4APDE4BPDE4CPDE4DNPC1
SCHEMBL7094216 0.68 EPHX2 (0.57) PDE4APDE4BPDE4CPDE4DNPC1
SCHEMBL29171624 0.68 PTPN1 (0.54) PDE4APDE4BPDE4CPDE4DNPC1

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
EP-0841913-B1 USE OF SULFAMIC ACID DERIVATIVES, ACYL SULFONAMIDES OR SULFONYL CARBAMATES FOR THE MANUFACTURE OF A MEDICAMENT FOR LOWERING LIPOPROTEIN LEVELS WARNER LAMBERT CO (US) 2003-02-05 EP claimed