SCHEMBL7054032

SCHEMBL7054032

CON=C(CN1CCOCC1)c1oc2c(OC)ccc(-c3c(Cl)cncc3Cl)c2c1C(N)=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 4/20 0.35
PDE4B Q07343 3/20 0.35
PDE4C Q08493 3/20 0.35
PDE4D Q08499 3/20 0.35
TP53 P04637 2/20 0.34
ALDH1A1 P00352 3/20 0.34
MAPT P10636 3/20 0.34
MAPK1 P28482 3/20 0.34
USP2 O75604 1/20 0.34
HTT P42858 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TGFBR1 P36897 1/20 0.33
ACVR1 Q04771 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
F2 P00734 1/20 0.32
F10 P00742 1/20 0.32

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
SCHEMBL7052513 0.86 ALDH1A1 (0.40) PDE4APDE4BPDE4CPDE4DTP53
SCHEMBL7052721 0.81 PDE4D (0.43) PDE4APDE4BPDE4CPDE4D
SCHEMBL7052278 0.78 PDE4D (0.52) PDE4APDE4BPDE4CPDE4DL3MBTL1
Morpholine SCHEMBL7050559 0.77 PDE4B (0.37) PDE4APDE4BPDE4CPDE4DTGFBR1
SCHEMBL7052696 0.77 PDE4D (0.44) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7054654 0.73 PDE4D (0.44) PDE4APDE4BPDE4CPDE4D
SCHEMBL7054167 0.73 PDE4D (0.40) PDE4APDE4BPDE4CPDE4D
SCHEMBL8352300 0.73 PDE4D (0.39) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL8357732 0.73 PDE4D (0.42) PDE4APDE4BPDE4CPDE4D
SCHEMBL7053281 0.71 PDE4D (0.46) PDE4APDE4BPDE4CPDE4D

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-0901482-B1 BENZOFURAN CARBOXAMIDES AND THEIR THERAPEUTIC USE DARWIN DISCOVERY LTD (GB) 2003-05-02 EP disclosed
US-5972936-A Benzofuran carboxamides and their therapeutic use DARWIN DISCOVER LIMITED (GB) 1999-10-26 US disclosed