SCHEMBL3467072

SCHEMBL3467072

Oc1cccc(-c2cnc3c(N4CCOCC4)nccn23)c1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 1/20 0.59
PDE6A P16499 1/20 0.59
PDE1B Q01064 1/20 0.59
PDE3A Q14432 1/20 0.59
PIK3CA P42336 9/20 0.56
PIK3R1 P27986 4/20 0.56
GRIA1 P42261 7/20 0.52
PIK3CD O00329 3/20 0.49
MTOR P42345 3/20 0.49
PIK3CG P48736 2/20 0.49
SLC6A3 Q01959 1/20 0.48
FYN P06241 1/20 0.48
CACNG2 Q9Y698 2/20 0.47

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
SCHEMBL3466485 0.86 GRIA1 (0.60) PDE5APDE6APDE1BPDE3AGRIA1
SCHEMBL3467020 0.86 PDE5A (0.60) PDE5APDE6APDE1BPDE3AGRIA1
SCHEMBL3467938 0.84 PDE5A (0.67) PDE5APDE6APDE1BPDE3APIK3CA
SCHEMBL3469763 0.81 DYRK1A (0.57) PDE5APDE6APDE1BPDE3AGRIA1
SCHEMBL3466882 0.79 KDM4E (0.48) FYN
SCHEMBL3467028 0.79 PDE5A (0.60) PDE5APDE6APDE1BPDE3AGRIA1
SCHEMBL3469571 0.76 PDE5A (0.63) PDE5APDE6APDE1BPDE3AGRIA1
SCHEMBL14767484 0.75 FYN (0.48) FYN
SCHEMBL3469240 0.74 PDE5A (1.00) PDE5APDE6APDE1BPDE3APIK3CA
SCHEMBL12618680 0.74 FYN (0.56) PIK3CAPIK3R1PIK3CDFYN

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
WO-2010069684-A1 COMPOUNDS FOR TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA, LTD. (BS) 2010-06-24 WO claimed
WO-2010069684-A1 COMPOUNDS FOR TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA, LTD. (BS) 2010-06-24 WO disclosed