SCHEMBL45674

SCHEMBL45674

CS(=O)(=O)NC(=O)c1ccc2c(=O)[nH]c(Cc3cccc(Cl)c3)nc2c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 4/20 0.71
CSNK2A2 P19784 2/20 0.49
CSNK2B P67870 2/20 0.49
CSNK2A1 P68400 1/20 0.49
CSNK2A3 Q8NEV1 1/20 0.49
POLB P06746 1/20 0.46
KDM4E B2RXH2 1/20 0.45
RECQL P46063 1/20 0.45
SCN2B O60939 1/20 0.45
SCN1A P35498 1/20 0.45
SCN1B Q07699 1/20 0.45
SCN5A Q14524 1/20 0.45
SCN9A Q15858 1/20 0.45
PDE9A O76083 1/20 0.43
PDE1A P54750 1/20 0.43
PDE1B Q01064 1/20 0.43
PDE1C Q14123 1/20 0.43
KMT2A Q03164 1/20 0.42
LMNA P02545 1/20 0.41
CCNE2 O96020 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
SCHEMBL37938 0.84 PDE5A (0.77) PDE5APOLBKDM4ERECQLPDE9A
SCHEMBL38105 0.84 PDE5A (1.00) PDE5ACSNK2A2CSNK2BCSNK2A1POLB
SCHEMBL37738 0.76 PDE5A (0.56) PDE5AKDM4EPDE9APDE1APDE1B
SCHEMBL401291 0.76 PDE5A (0.85) PDE5ACSNK2A2CSNK2BPOLBKDM4E
SCHEMBL17888986 0.75 PDE5A (0.72) PDE5APOLBKDM4ERECQLPDE9A
SCHEMBL400846 0.74 PDE5A (0.82) PDE5ACSNK2A2CSNK2BCSNK2A1POLB
SCHEMBL402247 0.74 PDE5A (0.78) PDE5ACSNK2A2CSNK2BCSNK2A1POLB
SCHEMBL405547 0.74 PDE5A (0.81) PDE5ACSNK2A2CSNK2BPOLBKDM4E
SCHEMBL403481 0.73 PDE5A (0.76) PDE5ACSNK2A1POLBKDM4ERECQL
SCHEMBL403178 0.73 PDE5A (0.78) PDE5ACSNK2A2CSNK2BCSNK2A1POLB

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