SCHEMBL14575985

SCHEMBL14575985

CCOC(=O)/C(C)=C/c1ccc(OC)c(OC2Cc3ccccc3C2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 9/20 0.50
PDE4A P27815 6/20 0.50
PDE4C Q08493 6/20 0.50
PDE4D Q08499 6/20 0.50
ALDH1A1 P00352 3/20 0.49
PKM P14618 1/20 0.49
HTT P42858 1/20 0.49
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
POLB P06746 2/20 0.45
MAPT P10636 4/20 0.43
GAA P10253 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
KDM4E B2RXH2 2/20 0.41
LMNA P02545 2/20 0.41
PLIN1 O60240 1/20 0.41
PLIN5 Q00G26 1/20 0.41
ABHD5 Q8WTS1 1/20 0.41
HPGD P15428 1/20 0.41
NPSR1 Q6W5P4 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
SCHEMBL6232036 0.90 MEN1 (0.53) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL5359098 0.87 PDE4B (0.56) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL5359095 0.87 PDE4B (0.56) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL6912242 0.86 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL6912241 0.86 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL5355223 0.85 PDE4B (0.58) PDE4BPDE4APDE4CPDE4DHTT
SCHEMBL5355215 0.85 PDE4B (0.58) PDE4BPDE4APDE4CPDE4DHTT
SCHEMBL5369892 0.84 PDE4B (0.54) PDE4BPDE4APDE4CPDE4DGAA
SCHEMBL5369901 0.84 PDE4B (0.54) PDE4BPDE4APDE4CPDE4DGAA
SCHEMBL498539 0.78 ALDH1A1 (0.60) PDE4BPDE4APDE4CPDE4DALDH1A1

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-7176229-B2 Cyclic AMP-specific phosphodiesterase inhibitors ICOS CORPORATION (US) 2007-02-13 US disclosed
US-7176229-B2 Cyclic AMP-specific phosphodiesterase inhibitors ICOS CORPORATION (US) 2007-02-13 US disclosed