SCHEMBL28820180

SCHEMBL28820180

NNC(=O)c1ccc(NC(=O)Cc2ccc(Cl)c(Cl)c2)cc1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.60
KMT2A Q03164 4/20 0.60
LMNA P02545 2/20 0.60
MAPT P10636 2/20 0.60
HTT P42858 2/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
POLB P06746 2/20 0.56
KDM4E B2RXH2 1/20 0.56
MAOB P27338 1/20 0.55
SMN1; SMN2 Q16637 2/20 0.54
ALDH1A1 P00352 2/20 0.52
HPGD P15428 1/20 0.52
MAPK1 P28482 1/20 0.52
PTGDR2 Q9Y5Y4 1/20 0.52

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
SCHEMBL28020740 0.85 MEN1 (0.62) MEN1KMT2ALMNAMAPTHTT
SCHEMBL28820179 0.81 MEN1 (0.52) MEN1KMT2ALMNAMAPTHTT
SCHEMBL25179157 0.81 GAA (0.71) MEN1KMT2ALMNAMAPTHTT
SCHEMBL1203812 0.80 LOXL2 (0.54) MEN1KMT2ALMNAMAPTHTT
SCHEMBL12231041 0.79 BCAT2 (0.58) MEN1KMT2ALMNAMAPTHTT
SCHEMBL28020308 0.78 PTGDR2 (0.50) MEN1KMT2ALMNAMAPTHTT
SCHEMBL6782525 0.76 ALDH1A1 (0.55) MEN1KMT2ALMNAMAPTHTT
SCHEMBL15757998 0.75 MEN1 (0.61) MEN1KMT2ALMNAMAPTHTT
SCHEMBL29994706 0.75 HPGD (0.62) MEN1KMT2ALMNAMAPTHTT
SCHEMBL1202191 0.75 HPGD (0.62) MEN1KMT2ALMNAMAPTHTT

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
CN-102775381-B Substituted hydrazide compound, and its preparation method, medicinal compositions and application SHANGHAI INST MATERIA MEDICA 2015-05-20 CN disclosed