SCHEMBL10692089

SCHEMBL10692089

COc1cc(SC)ccc1-c1nc2nc(OCc3ccccc3)ncc2[nH]1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 4/20 0.43
PDE4A P27815 2/20 0.43
PDE4B Q07343 2/20 0.43
PDE4C Q08493 2/20 0.43
PDE4D Q08499 2/20 0.43
PDE2A O00408 1/20 0.41
AURKA O14965 1/20 0.39
PDGFRB P09619 1/20 0.39
PDGFRA P16234 1/20 0.39
PRMT5 O14744 4/20 0.38
HPGD P15428 3/20 0.38
LMNA P02545 2/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 2/20 0.38
KMT2A Q03164 2/20 0.38
CYP1A2 P05177 2/20 0.38
KDM4E B2RXH2 1/20 0.38
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL10691792 0.87 PDE2A (0.56) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL10611572 0.87 PDE2A (0.51) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL10691379 0.86 PDE2A (0.46) PDE5APDE2AAURKAHPGDLMNA
SCHEMBL10685936 0.83 PDE2A (0.51) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL10762663 0.79 PDE2A (0.45) PDE5APDE2AAURKAHPGDLMNA
SCHEMBL10760424 0.77 PDE2A (0.44) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL10692327 0.77 PDE5A (0.43) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL10686094 0.76 PDE2A (0.50) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL11233387 0.76 PDE2A (0.48) PDE5APDE2AAURKAHPGDLMNA
SCHEMBL10690326 0.75 PDE4A (0.48) PDE5APDE4APDE4BPDE4CPDE4D

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
US-4722929-A Novel 2-phenyl-imidazoles and pharmaceutical compositions containing same DR. KARL THOMAE GMBH (DE) 1988-02-02 US disclosed
EP-0149200-A1 Novel 2-pnenyl-imidazoles, their preparation and drugs containing them Dr. Karl Thomae GmbH (DE) 1985-07-24 EP disclosed