SCHEMBL27722211

SCHEMBL27722211

Nc1cc(Cl)cn2c(NCC(=O)NO)c(Cc3ccccc3)nc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 2/20 0.35
HDAC8 Q9BY41 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
ADRA1D P25100 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
GAA P10253 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33
CYP2C19 P33261 1/20 0.33
MMP1 P03956 1/20 0.33
MMP7 P09237 1/20 0.33
MMP8 P22894 1/20 0.33
MMP12 P39900 1/20 0.33
MMP13 P45452 1/20 0.33
ABCB1 P08183 1/20 0.33
MEP1B Q16820 1/20 0.33

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
SCHEMBL27701643 0.89 TSHR (0.37) PLAUHDAC8MEN1KMT2AHDAC6
SCHEMBL27722198 0.85
SCHEMBL27701824 0.84 HDAC1 (0.34) HDAC8HDAC6ALDH1A1CYP1A2GAA
SCHEMBL27701758 0.83 PLAU (0.40) PLAUHDAC8MEN1KMT2AHDAC6
SCHEMBL27722380 0.80 HDAC1 (0.40)
SCHEMBL28768875 0.79 ALDH1A1 (0.43) HDAC8MEN1KMT2AALDH1A1
SCHEMBL27701807 0.77 PLAU (0.44) PLAUHDAC8MEN1KMT2AHDAC6
SCHEMBL27722258 0.77 HDAC1 (0.33)
SCHEMBL27722212 0.75 PLAU (0.39) PLAUHDAC8MEN1KMT2AHDAC6
SCHEMBL27701698 0.74 HDAC8 (0.45) HDAC8MEN1KMT2AALDH1A1CYP1A2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101163703-B Imidazo [1,2-A ] pyridine derivatives as Peptide Deformylase (PDF) inhibitors NOVARTIS AG 2010-12-15 CN disclosed
CN-101163703-A Imidazo [1, 2-A ] pyridine derivatives as Peptide Deformylase (PDF) inhibitors NOVARTIS AG (CH) 2008-04-16 CN disclosed