SCHEMBL46296

SCHEMBL46296

CCOC(=O)c1cc2nc(Cc3ccc(F)c(Cl)c3)[nH]c(=O)c2s1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 3/20 0.56
KMT2A Q03164 3/20 0.41
LMNA P02545 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
KCNH2 Q12809 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
CCNE1 P24864 2/20 0.40
CDK2 P24941 2/20 0.40
CDC7 O00311 1/20 0.40
ROCK1 Q13464 1/20 0.40
DBF4 Q9UBU7 1/20 0.40
RNASEH1 O60930 1/20 0.40
MEN1 O00255 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PIP4K2A P48426 1/20 0.39
RAB9A P51151 2/20 0.39
KDM4E B2RXH2 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 2/20 0.38
HPGD P15428 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
SCHEMBL38484 0.91 PDE5A (0.57) PDE5AKMT2ALMNANPSR1KCNH2
SCHEMBL10084040 0.89 PDE5A (0.59) PDE5AKMT2ALMNANPSR1KCNH2
SCHEMBL46310 0.87 PDE5A (0.74) PDE5ALMNACCNE1CDK2CDC7
SCHEMBL46289 0.86 PDE5A (0.76) PDE5AKMT2ALMNACCNE1CDK2
SCHEMBL10083509 0.84 PDE5A (0.58) PDE5AKMT2ALMNANPSR1CCNE1
SCHEMBL38373 0.83 PDE5A (0.61) PDE5AKMT2ARXFP1CCNE1CDK2
SCHEMBL46291 0.80 PDE5A (0.50) PDE5AKMT2ALMNACCNE1CDK2
SCHEMBL4505873 0.79 KMT2A (0.64) KMT2ALMNANPSR1KCNH2RXFP1
SCHEMBL46456 0.77 PDE5A (0.57) PDE5AKMT2ALMNACCNE1CDK2
SCHEMBL46453 0.77 KDM4E (0.50) PDE5ALMNARXFP1CCNE1CDK2

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