SCHEMBL7368236

SCHEMBL7368236

COc1ccc(-c2csc(C)n2)cc1OC1CC2CCC1C2

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 9/20 0.56
PDE4A P27815 8/20 0.56
PDE4C Q08493 8/20 0.56
PDE4D Q08499 8/20 0.56
MAPT P10636 2/20 0.52
GAA P10253 1/20 0.52
RECQL P46063 1/20 0.52
GFER P55789 1/20 0.52
PDGFRB P09619 2/20 0.44
PDGFRA P16234 2/20 0.44
PKM P14618 1/20 0.42
PDE3B Q13370 1/20 0.41
PDE3A Q14432 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HCRTR1 O43613 1/20 0.41
HCRTR2 O43614 1/20 0.41

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
SCHEMBL7374459 0.82 PDE4B (0.59) PDE4BPDE4APDE4CPDE4DGAA
SCHEMBL7358558 0.78 PDE4B (0.59) PDE4BPDE4APDE4CPDE4DPDGFRB
SCHEMBL6040790 0.78 MAPT (0.75) MAPTGAARECQLGFERPKM
SCHEMBL7359192 0.76 PDE4B (0.64) PDE4BPDE4APDE4CPDE4DPDGFRB
SCHEMBL7369053 0.76 ALDH1A1 (0.65) PDE4BPDE4APDE4CPDE4DMAPT
Hydrochloric Acid SCHEMBL7363927 0.76 PDE4B (0.58) PDE4BPDE4APDE4CPDE4DPDGFRB
SCHEMBL7368338 0.76 PDE4B (0.71) PDE4BPDE4APDE4CPDE4DPDGFRB
SCHEMBL7366624 0.75 PDE4B (0.62) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7360400 0.74 PDE4B (0.67) PDE4BPDE4APDE4CPDE4DPDGFRB
SCHEMBL7368326 0.72 PDE4B (0.62) PDE4BPDE4APDE4CPDE4DPDGFRB

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
EP-0672031-A1 CATECHOL DIETHERS AS SELECTIVE PDE IV? INHIBITORS PFIZER INC. (US) 1995-09-20 EP disclosed
WO-1994012461-A1 CATECHOL DIETHERS AS SELECTIVE PDEIV INHIBITORS PFIZER INC. (US) 1994-06-09 WO disclosed