SCHEMBL10373374

SCHEMBL10373374

CC1(C)C(=O)Nc2cc3[nH]c(-c4ccc(O)cc4)nc3cc21

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 2/20 0.68
PDE3A Q14432 2/20 0.68
PDE4A P27815 1/20 0.68
PDE4B Q07343 1/20 0.68
PDE4C Q08493 1/20 0.68
PDE4D Q08499 1/20 0.68
AURKB Q96GD4 2/20 0.54
AURKA O14965 1/20 0.54
NPBWR1 P48145 1/20 0.49
SCD O00767 1/20 0.48
GUSB P08236 2/20 0.47
DGAT1 O75907 1/20 0.44
KCNH2 Q12809 1/20 0.44
CHEK1 O14757 1/20 0.44
PRKD3 O94806 1/20 0.44
PAK4 O96013 1/20 0.44
PDGFRA P16234 1/20 0.44
LTK P29376 1/20 0.44
MAP2K2 P36507 1/20 0.44
MAPK8 P45983 1/20 0.44

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
SCHEMBL10374221 0.88 PDE4A (0.68) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10375588 0.87 PDE4A (0.71) PDE3BPDE3APDE4APDE4BPDE4C
Adibendan SCHEMBL9832050 0.86 PDE3B (0.90) PDE3BPDE3APDE4APDE4BPDE4C
Adibendan SCHEMBL10470994 0.85 PDE3B (0.88) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10373612 0.84 PDE4A (0.67) PDE3BPDE3APDE4APDE4BPDE4C
Hydrochloric Acid SCHEMBL10478146 0.84 PDE3B (0.64) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10374847 0.84 PDE4A (0.64) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10372929 0.83 PDE3B (0.62) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9677178 0.82 PDE3B (0.75) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9835173 0.81 PDE3B (0.54) PDE3BPDE3APDE4APDE4BPDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0186010-B1 PYRROLO BENZIMIDAZOLES, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM Roche Diagnostics GmbH (DE) 1990-01-31 EP claimed
US-4710510-A Pyrrolobenzimidazoles, pharmaceutical compositions containing them, and use of them to treat certain heart and circulatory diseases BOEHRINGER MANNHEIM GMBH (DE) 1987-12-01 US claimed
EP-0186010-A1 Pyrrolo benzimidazoles, process for their preparation and medicaments containing them Roche Diagnostics GmbH (DE) 1986-07-02 EP claimed
EP-0186010-B1 PYRROLO BENZIMIDAZOLES, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM Roche Diagnostics GmbH (DE) 1990-01-31 EP disclosed
US-4810801-A Pyrrolobenzimidazoles, pharmaceutical compositions containing them, and use of them to treat certain heart and circulatory diseases BOEHRINGER MANNHEIM GMBH (DE) 1989-03-07 US disclosed
US-4710510-A Pyrrolobenzimidazoles, pharmaceutical compositions containing them, and use of them to treat certain heart and circulatory diseases BOEHRINGER MANNHEIM GMBH (DE) 1987-12-01 US disclosed
EP-0186010-A1 Pyrrolo benzimidazoles, process for their preparation and medicaments containing them Roche Diagnostics GmbH (DE) 1986-07-02 EP disclosed