SCHEMBL25904296

SCHEMBL25904296

N#Cc1ccc(-c2ccc3[nH]c(=O)ccc3c2Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAP2 P11137 1/20 0.41
CHEK1 O14757 1/20 0.41
WEE1 P30291 1/20 0.41
FLT3 P36888 8/20 0.40
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
FASN P49327 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
RXFP1 Q9HBX9 1/20 0.38
IDO1 P14902 1/20 0.36
GSK3A P49840 1/20 0.36
GSK3B P49841 1/20 0.36
CDK5 Q00535 1/20 0.36
CDK5R1 Q15078 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
RHEB Q15382 1/20 0.36

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
SCHEMBL25903699 0.83 PDE3B (0.55) WEE1PDE3BPDE3AMEN1KMT2A
SCHEMBL25904763 0.80 MEN1 (0.58) FLT3PDE3BPDE3AMEN1KMT2A
SCHEMBL25904145 0.77 CNR1 (0.40) PDE3BPDE3AMEN1KMT2ARXFP1
SCHEMBL25903697 0.77 PDE3B (0.56) MAP2CHEK1WEE1PDE3BPDE3A
SCHEMBL25904272 0.75 F11 (0.45) MAP2CHEK1WEE1PDE3BPDE3A
SCHEMBL25905129 0.74 TNKS2 (0.41) CHEK1WEE1PDE3BPDE3AMEN1
SCHEMBL25905198 0.74 PDE3B (0.41) PDE3BPDE3AMEN1KMT2ARXFP1
SCHEMBL10378102 0.71 PDE3B (0.68) PDE3BPDE3A
SCHEMBL25904123 0.70 KDM4E (0.38) PDE3BPDE3AMEN1KMT2ARXFP1
SCHEMBL32659853 0.70 PDE3B (0.57) PDE3BPDE3ARHEB

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-2023147513-A2 COMPOSITIONS OF AUTOPHAGY MODULATING AGENTS AND USES THEREOF WASHINGTON UNIVERSITY (US) 2023-08-03 WO disclosed