SCHEMBL25905129

SCHEMBL25905129

O=c1ccc2c(Cl)c(-c3ccc(Cl)c(O)c3)ccc2[nH]1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TNKS2 Q9H2K2 4/20 0.41
PDE3B Q13370 2/20 0.40
PDE3A Q14432 2/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HTT P42858 1/20 0.39
TRPV1 Q8NER1 1/20 0.39
DAO P14920 2/20 0.38
RXFP1 Q9HBX9 1/20 0.38
WEE1 P30291 2/20 0.38
F11 P03951 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
AHR P35869 1/20 0.37
CHEK1 O14757 1/20 0.36
PIK3CA P42336 1/20 0.36
LMNA P02545 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
SCHEMBL25904278 0.81 CHEK1 (0.45) TNKS2PDE3BPDE3AMEN1KMT2A
SCHEMBL25903699 0.80 PDE3B (0.55) PDE3BPDE3AMEN1KMT2AHTT
SCHEMBL25904303 0.79 F11 (0.50) PDE3BPDE3AMEN1KMT2ADAO
SCHEMBL25904763 0.77 MEN1 (0.58) TNKS2PDE3BPDE3AMEN1KMT2A
SCHEMBL25905198 0.77 PDE3B (0.41) TNKS2PDE3BPDE3AMEN1KMT2A
SCHEMBL2957821 0.76 F11 (0.46) PDE3BPDE3AMEN1KMT2ARXFP1
SCHEMBL25904145 0.74 CNR1 (0.40) PDE3BPDE3AMEN1KMT2ARXFP1
SCHEMBL25903697 0.74 PDE3B (0.56) PDE3BPDE3AMEN1KMT2AWEE1
SCHEMBL25904296 0.74 MAP2 (0.41) PDE3BPDE3AMEN1KMT2ARXFP1
SCHEMBL25904123 0.73 KDM4E (0.38) PDE3BPDE3AMEN1KMT2ARXFP1

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