SCHEMBL7408786

SCHEMBL7408786

COc1ccc(CO)c(-c2ccccc2)c1OC1CCCC1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 8/20 0.44
PDE4D Q08499 7/20 0.44
PDE4B Q07343 5/20 0.44
PDE4C Q08493 5/20 0.44
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
EPHX2 P34913 1/20 0.39
RECQL P46063 1/20 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
SCHEMBL7281786 0.82 PDE4B (0.47) PDE4APDE4DPDE4BPDE4CKMT2A
SCHEMBL2490787 0.76 KDM4E (0.45) PDE4APDE4DPDE4BPDE4CKMT2A
SCHEMBL31134292 0.70 PDE4B (0.47) PDE4APDE4DPDE4BPDE4C
SCHEMBL9376230 0.70 PDE4B (0.47) PDE4APDE4DPDE4BPDE4CMAPT
SCHEMBL7280434 0.69 PDE5A (0.45) PDE4APDE4DPDE4BPDE4CKMT2A
SCHEMBL3401123 0.68 KMT2A (0.47) PDE4APDE4DPDE4BPDE4CKMT2A
SCHEMBL7696540 0.68 PDE4A (0.72) PDE4APDE4DPDE4BPDE4C
SCHEMBL2354338 0.68 CARM1 (0.51) EPHX2
SCHEMBL5132385 0.68 PDE4D (0.42) PDE4APDE4DPDE4BPDE4CKMT2A
SCHEMBL3407610 0.68 THRA (0.43) PDE4APDE4DPDE4BPDE4CKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0796093-A4 COMPOUNDS FOR AND METHOD OF INHIBITING PHOSPHODIESTERASE IV EURO CELTIQUE SA (LU) 1998-05-13 EP disclosed
EP-0796093-A1 COMPOUNDS FOR AND METHOD OF INHIBITING PHOSPHODIESTERASE IV Euroceltique S.A. (LU) 1997-09-24 EP disclosed
WO-1996021435-A1 COMPOUNDS FOR AND METHOD OF INHIBITING PHOSPHODIESTERASE IV EURO-CELTIQUE, S.A. (LU) 1996-07-18 WO disclosed