SCHEMBL27701650

SCHEMBL27701650

Cc1nc2ccc(Br)c(C)n2c1NCC(=O)NO

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.32
RAB9A P51151 4/20 0.32
NPC1 O15118 2/20 0.32
GFER P55789 1/20 0.32
PDE5A O76074 1/20 0.31
ALDH1A1 P00352 4/20 0.30
SMN1; SMN2 Q16637 3/20 0.30
LMNA P02545 2/20 0.30
HTT P42858 2/20 0.30
TP53 P04637 2/20 0.30
POLB P06746 1/20 0.30
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
MCHR1 Q99705 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MAPT P10636 1/20 0.30
ALOX15 P16050 1/20 0.30
P2RX7 Q99572 1/20 0.30
HDAC3 O15379 1/20 0.30
HDAC4 P56524 1/20 0.30

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
SCHEMBL27722260 0.86 HDAC1 (0.36) GAARAB9ANPC1GFERPDE5A
SCHEMBL27722263 0.85 HDAC1 (0.35) HDAC1
SCHEMBL27722225 0.83 HDAC1 (0.34) KDM4EHDAC1
SCHEMBL27722344 0.83 NR1H4 (0.30)
SCHEMBL27722204 0.82 HDAC1 (0.44) HDAC1
SCHEMBL27722187 0.82 GPR139 (0.38) GAARAB9ANPC1GFERALDH1A1
SCHEMBL27701659 0.81 HDAC6 (0.37) GAARAB9ANPC1GFERALDH1A1
SCHEMBL27701664 0.78 HTT (0.39) GAARAB9ANPC1ALDH1A1SMN1; SMN2
SCHEMBL27701766 0.77 GRIN1 (0.34) GAAPDE5AALDH1A1HTTKMT2A
SCHEMBL27701710 0.75 GAA (0.32) GAAHDAC1

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