SCHEMBL25293156

SCHEMBL25293156

COC(=O)c1ccc2nc(Cl)n3cc(C)nc3c2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.51
GAA P10253 3/20 0.46
ALDH1A1 P00352 5/20 0.43
TDP1 Q9NUW8 3/20 0.43
MAPT P10636 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
MAPK1 P28482 1/20 0.43
KDM4E B2RXH2 5/20 0.41
KMT2A Q03164 3/20 0.41
MITF O75030 1/20 0.41
ALOX15 P16050 1/20 0.41
HTT P42858 1/20 0.41
PIK3CA P42336 1/20 0.40
PIK3CB P42338 1/20 0.40
PIK3CG P48736 1/20 0.40
PI4KB Q9UBF8 1/20 0.40
RAB9A P51151 4/20 0.39
NPC1 O15118 3/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39

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
SCHEMBL25242985 0.90 CSNK2A1 (0.46) TP53GAAALDH1A1TDP1MAPT
SCHEMBL25282602 0.80 TP53 (0.49) TP53GAAALDH1A1TDP1MAPT
SCHEMBL25290589 0.76 ALDH1A1 (0.49) TP53ALDH1A1TDP1MAPTKDM4E
SCHEMBL25249722 0.75 ALDH1A1 (0.47) ALDH1A1MAPTL3MBTL1KDM4ECYP1A2
SCHEMBL25245871 0.75 CSNK2A1 (0.44) TP53ALDH1A1MAPTKDM4ECYP1A2
SCHEMBL30251615 0.75 TP53 (0.65) TP53GAAALDH1A1TDP1MAPT
SCHEMBL5093476 0.75 TP53 (0.65) TP53GAAALDH1A1TDP1MAPT
SCHEMBL2116682 0.74 TP53 (0.46) TP53GAAALDH1A1TDP1MAPT
SCHEMBL25285817 0.74 TLR7 (0.48) ALDH1A1TDP1MAPTKDM4EKMT2A
SCHEMBL30487001 0.74 DRD2 (0.48) TP53GAAALDH1A1TDP1MAPT

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-2023126951-A1 INHIBITORS OF AUTOPHAGY-RELATED PROTEIN-PROTEIN INTERACTIONS YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2023-07-06 WO disclosed