SCHEMBL28558394

SCHEMBL28558394

COC(=O)c1ccccc1NC(=O)c1ccc(Sc2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])c1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.52
HTT P42858 2/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
NPY1R P25929 1/20 0.51
MC4R P32245 1/20 0.51
NPY2R P49146 1/20 0.51
MAPT P10636 7/20 0.49
GAA P10253 2/20 0.49
BCL2L1 Q07817 2/20 0.48
POLB P06746 2/20 0.48
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
THRB P10828 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.46
NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL28554455 0.90 BCL2L1 (0.58) LMNAHTTL3MBTL1NPY1RMC4R
SCHEMBL28574425 0.83 MEN1 (0.56) LMNAHTTMAPTGAAPOLB
SCHEMBL28549957 0.83 ALDH1A1 (0.44) LMNAHTTL3MBTL1MAPTBCL2L1
SCHEMBL28560359 0.77 TSHR (0.62) LMNAL3MBTL1NPY1RMC4RNPY2R
SCHEMBL28549966 0.76 POLB (0.80) LMNAHTTMAPTGAABCL2L1
SCHEMBL28565202 0.76 MEN1 (0.57) LMNAHTTMAPTGAABCL2L1
SCHEMBL28563146 0.75 MAPT (0.44) LMNAL3MBTL1MAPTBCL2L1POLB
SCHEMBL28553419 0.74 HTT (0.49) LMNAHTTL3MBTL1MAPTBCL2L1
SCHEMBL31404874 0.73 SLC25A1 (0.43) LMNAHTTL3MBTL1MAPTGAA
SCHEMBL31404883 0.73 SLC25A1 (0.43) LMNAL3MBTL1MAPTGAAALDH1A1

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-112638909-A Compounds with antibacterial activity 香港理工大学 2021-04-09 CN disclosed