SCHEMBL31270689

SCHEMBL31270689

C#CCNC(=O)c1cc(NC(=O)Nc2ccc(C3=NCCN3)cc2)cc(NC(=O)Nc2ccc(C3=NCCN3)cc2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.56
NISCH Q9Y2I1 1/20 0.53
ACHE P22303 1/20 0.50
UBE2N P61088 3/20 0.49
PAX8 Q06710 1/20 0.49
LMNA P02545 1/20 0.49
POLB P06746 3/20 0.48
KMT2A Q03164 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
RUVBL1 Q9Y265 1/20 0.46
PRMT1 Q99873 1/20 0.46
FDPS P14324 1/20 0.46
BLM P54132 2/20 0.45
MEN1 O00255 1/20 0.45
USP2 O75604 1/20 0.45
MAPT P10636 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MAP2K7 O14733 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
SCHEMBL31270687 0.90 PPARG (0.54) PPARGNISCHACHEUBE2NPAX8
SCHEMBL15788315 0.88 PPARG (0.61) PPARGNISCHACHEUBE2NPAX8
SCHEMBL31270763 0.81 NISCH (0.60) PPARGNISCHACHEUBE2NPAX8
SCHEMBL25602980 0.80 RUVBL1 (0.55) PPARGNISCHACHEUBE2NPAX8
Formic Acid SCHEMBL31271011 0.77 PPARG (0.58) PPARGNISCHACHEUBE2NPAX8
SCHEMBL17086964 0.76 ACHE (0.82) PPARGNISCHACHEUBE2NPAX8
SCHEMBL25607127 0.76 POLB (0.70) PPARGNISCHACHEUBE2NLMNA
SCHEMBL31270741 0.76 NISCH (0.52) PPARGNISCHACHEUBE2NPAX8
SCHEMBL31270776 0.76 NISCH (0.55) PPARGNISCHACHEUBE2NPAX8
SCHEMBL25606799 0.75 ACHE (0.70) PPARGNISCHACHEUBE2NPAX8

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-2024220676-A1 MRNA DEGRADERS AND METHODS OF USE THEREOF UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2024-10-24 WO disclosed