SCHEMBL46310

SCHEMBL46310

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

nearest known ligand 0.74

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 3/20 0.74
RNASEH1 O60930 1/20 0.48
RAB9A P51151 2/20 0.42
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CACNA1B Q00975 1/20 0.39
PARP1 P09874 1/20 0.39
POLB P06746 1/20 0.39
JAK2 O60674 1/20 0.38
ZAP70 P43403 1/20 0.38
SYK P43405 1/20 0.38
CDC7 O00311 1/20 0.38
CCNE1 P24864 1/20 0.38
CDK2 P24941 1/20 0.38
ROCK1 Q13464 1/20 0.38
DBF4 Q9UBU7 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
SCHEMBL37942 0.88 PDE5A (0.78) PDE5ARNASEH1RAB9AKDM4ELMNA
SCHEMBL46296 0.87 PDE5A (0.56) PDE5ARNASEH1RAB9AKDM4ELMNA
SCHEMBL44227 0.85 PDE5A (0.67) PDE5ARNASEH1RAB9ALMNACDC7
SCHEMBL37798 0.85 PDE5A (1.00) PDE5ARNASEH1RAB9AKDM4ELMNA
SCHEMBL38065 0.83 PDE5A (0.77) PDE5ARNASEH1RAB9ACDC7CCNE1
SCHEMBL38005 0.82 PDE5A (0.69) PDE5ARNASEH1KDM4ECDC7CCNE1
SCHEMBL37513 0.82 PDE5A (0.79) PDE5ARNASEH1KDM4ECDC7CCNE1
SCHEMBL38180 0.80 PDE5A (0.60) PDE5ARNASEH1RAB9AKDM4ELMNA
SCHEMBL37583 0.79 PDE5A (0.78) PDE5ARNASEH1KDM4ECDC7CCNE1
SCHEMBL37737 0.79 PDE5A (0.68) PDE5ARNASEH1RAB9AKDM4ELMNA

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