SCHEMBL9227906

SCHEMBL9227906

O=[N+]([O-])c1ccccc1S(=O)(=O)NCCCn1cccn1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.56
KMT2A Q03164 2/20 0.54
F13A1 P00488 4/20 0.52
TGM1 P22735 4/20 0.52
MEN1 O00255 1/20 0.51
CYP19A1 P11511 1/20 0.48
NPY5R Q15761 4/20 0.47
HTT P42858 1/20 0.47
LMNA P02545 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
MMP1 P03956 1/20 0.46
MMP2 P08253 1/20 0.46
MMP9 P14780 1/20 0.46
MMP8 P22894 1/20 0.46
MMP13 P45452 1/20 0.46

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
SCHEMBL29571128 0.81 KMT2A (0.68) ALDH1A1KMT2AF13A1TGM1MEN1
SCHEMBL31284709 0.81 KMT2A (0.68) ALDH1A1KMT2AF13A1TGM1MEN1
SCHEMBL27006685 0.81 KMT2A (0.68) ALDH1A1KMT2AF13A1TGM1MEN1
SCHEMBL9229237 0.81 IKBKB (0.43) ALDH1A1KMT2ACYP19A1LMNA
SCHEMBL9226499 0.81 POLB (0.64) ALDH1A1KMT2AF13A1TGM1CYP19A1
SCHEMBL3540913 0.79 KMT2A (0.66) ALDH1A1KMT2AF13A1TGM1MEN1
SCHEMBL8578058 0.79 KMT2A (0.61) ALDH1A1KMT2AMEN1CYP19A1NPY5R
SCHEMBL31720671 0.78 KAT2B (0.57) ALDH1A1KMT2AMEN1HTTLMNA
SCHEMBL30649118 0.78 KMT2A (0.71) ALDH1A1KMT2AMEN1CYP19A1NPY5R
SCHEMBL4389696 0.78 KMT2A (0.71) ALDH1A1KMT2AMEN1CYP19A1NPY5R

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
US-5397798-A Benzamide and sulfonamide hypoglycemic agents ELI LILLY AND COMPANY (US) 1995-03-14 US disclosed
EP-0491525-A1 Benzamide and sulfonamide hypoglycemic agents ELI LILLY AND COMPANY (US) 1992-06-24 EP disclosed