SCHEMBL46289

SCHEMBL46289

CCOC(=O)c1cc2nc(Cc3cccc(Cl)c3)[nH]c(=O)c2s1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 4/20 0.76
PDE3B Q13370 1/20 0.53
PDE3A Q14432 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.47
LMNA P02545 2/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
MAPK1 P28482 1/20 0.47
ALOX5 P09917 6/20 0.45
PDE9A O76083 1/20 0.45
PDE1A P54750 1/20 0.45
PDE1B Q01064 1/20 0.45
PDE1C Q14123 1/20 0.45
PTGES O14684 2/20 0.43
CCNE1 P24864 2/20 0.43
CDK2 P24941 2/20 0.43
CCNE2 O96020 1/20 0.43
TRPM8 Q7Z2W7 1/20 0.42

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
SCHEMBL10084040 0.89 PDE5A (0.59) PDE5APDE3BPDE3ASMN1; SMN2LMNA
SCHEMBL38373 0.89 PDE5A (0.61) PDE5APDE3BPDE3ASMN1; SMN2KMT2A
SCHEMBL10083509 0.88 PDE5A (0.58) PDE5APDE3BPDE3ALMNAKMT2A
SCHEMBL38484 0.87 PDE5A (0.57) PDE5APDE3BPDE3ASMN1; SMN2LMNA
SCHEMBL37798 0.86 PDE5A (1.00) PDE5ASMN1; SMN2LMNAKMT2AMAPT
SCHEMBL46296 0.86 PDE5A (0.56) PDE5APDE3BPDE3ASMN1; SMN2LMNA
SCHEMBL37864 0.85 PDE5A (0.82) PDE5APDE3BPDE3ASMN1; SMN2LMNA
SCHEMBL37626 0.85 PDE5A (0.80) PDE5APDE3BPDE3ASMN1; SMN2LMNA
SCHEMBL4515609 0.84 PDE5A (0.76) PDE5APDE3BPDE3ASMN1; SMN2LMNA
SCHEMBL46291 0.82 PDE5A (0.50) PDE5ALMNAKMT2AMEN1ALDH1A1

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
WO-2012004900-A1 THIENOPYRIMIDINE COMPOUNDS ASKA PHARMACEUTICAL CO., LTD. (JP) 2012-01-12 WO disclosed