SCHEMBL38373

SCHEMBL38373

CCOC(=O)c1cc2nc(Cc3ccccc3)[nH]c(=O)c2s1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 1/20 0.61
RNASEH1 O60930 2/20 0.48
KMT2A Q03164 3/20 0.48
PDE3B Q13370 1/20 0.46
PDE3A Q14432 1/20 0.46
CDC7 O00311 3/20 0.46
CCNE1 P24864 3/20 0.46
CDK2 P24941 3/20 0.46
ROCK1 Q13464 3/20 0.46
DBF4 Q9UBU7 3/20 0.46
KDM4E B2RXH2 3/20 0.45
ALDH1A1 P00352 1/20 0.45
NPC1 O15118 1/20 0.45
MAPT P10636 1/20 0.45
CASP3 P42574 1/20 0.45
RAB9A P51151 1/20 0.45
ATM Q13315 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
SENP6 Q9GZR1 1/20 0.45

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) PDE5AKMT2APDE3BPDE3ACDC7
SCHEMBL10083509 0.89 PDE5A (0.58) PDE5AKMT2APDE3BPDE3ACDC7
SCHEMBL46289 0.89 PDE5A (0.76) PDE5AKMT2APDE3BPDE3ACDC7
SCHEMBL46291 0.86 PDE5A (0.50) PDE5AKMT2ACDC7CCNE1CDK2
SCHEMBL37513 0.86 PDE5A (0.79) PDE5ARNASEH1KMT2ACDC7CCNE1
SCHEMBL38484 0.85 PDE5A (0.57) PDE5ARNASEH1KMT2APDE3BPDE3A
SCHEMBL46453 0.85 KDM4E (0.50) PDE5ACDC7CCNE1CDK2ROCK1
SCHEMBL46296 0.83 PDE5A (0.56) PDE5ARNASEH1KMT2APDE3BPDE3A
SCHEMBL3491252 0.82 PDE5A (0.61) PDE5ARNASEH1KMT2APDE3BPDE3A
SCHEMBL37583 0.79 PDE5A (0.78) PDE5ARNASEH1KMT2ACDC7CCNE1

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