SCHEMBL6609734

SCHEMBL6609734

Cc1noc(C)c1NC(=O)Oc1ccc(OC(F)F)c2oc(C3CCOC3)cc12

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 9/20 0.35
PDE4A P27815 5/20 0.33
PDE4B Q07343 5/20 0.33
PDE4C Q08493 5/20 0.33
F9 P00740 1/20 0.32
F10 P00742 1/20 0.32
PLAU P00749 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KDM1A O60341 1/20 0.31
PIK3CG P48736 1/20 0.31
DHODH Q02127 1/20 0.31
MAPT P10636 1/20 0.30
BRD4 O60885 1/20 0.30
KCNK3 O14649 2/20 0.30

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
SCHEMBL6604500 0.90 PDE4D (0.37) PDE4DPDE4APDE4BPDE4CPLAU
SCHEMBL6604220 0.78 KDM4E (0.41) PDE4DPDE4APDE4BPDE4CF9
SCHEMBL6608204 0.75 ALDH1A1 (0.36) PDE4DKDM4EALDH1A1MAPTBRD4
SCHEMBL6604464 0.74 PDE4D (0.41) PDE4DPDE4APDE4BPDE4CMAPT
SCHEMBL6606725 0.71 PDE4D (0.36) PDE4DPDE4APDE4BPDE4CPLAU
SCHEMBL6611886 0.70 HTT (0.36) ALDH1A1PIK3CGMAPTBRD4KCNK3
SCHEMBL6612329 0.69 KDM4E (0.35) F9F10PLAUKDM4EALDH1A1
SCHEMBL6610234 0.68 MAPT (0.32) F9F10PLAUKDM4EALDH1A1
SCHEMBL6607492 0.67 PDE4A (0.42) PDE4DPDE4APDE4BPDE4CALDH1A1
SCHEMBL7019078 0.67 PDE4A (0.44) PDE4DPDE4APDE4BPDE4CF9

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-1257548-B1 BENZOFURAN CARBOXAMIDES AND THEIR THERAPEUTIC USE DARWIN DISCOVERY LTD (GB) 2004-05-06 EP claimed