SCHEMBL9703345

SCHEMBL9703345

O=[N+]([O-])c1ccc(S(=O)(=O)Nc2cnc3ccccc3n2)cc1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.69
CYP2C9 P11712 1/20 0.69
KMT2A Q03164 10/20 0.64
MEN1 O00255 9/20 0.64
ATIC P31939 1/20 0.60
MAPK1 P28482 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
CASP6 P55212 1/20 0.56
CA12 O43570 1/20 0.55
CA2 P00918 1/20 0.55
CA9 Q16790 1/20 0.55
RAB9A P51151 2/20 0.55
NPC1 O15118 1/20 0.55
POLB P06746 1/20 0.52
HTT P42858 1/20 0.51
KDM4E B2RXH2 1/20 0.51

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
SCHEMBL30517293 0.84 LMNA (0.78) LMNACYP2C9KMT2AMEN1ATIC
SCHEMBL1414326 0.84 LMNA (0.78) LMNACYP2C9KMT2AMEN1ATIC
SCHEMBL28007728 0.82 KDM4E (0.68) LMNAKMT2AMEN1MAPK1SMN1; SMN2
Sulfaquinoxaline SCHEMBL4435622 0.82 LMNA (1.00) LMNACYP2C9KMT2AMEN1ATIC
Sulfaquinoxaline SCHEMBL93789 0.82 LMNA (1.00) LMNACYP2C9KMT2AMEN1ATIC
Sulfaquinoxaline SCHEMBL29391090 0.82 LMNA (1.00) LMNACYP2C9KMT2AMEN1ATIC
SCHEMBL15256346 0.82 LMNA (0.74) LMNACYP2C9KMT2AMEN1ATIC
Sulfaquinoxaline SCHEMBL27961007 0.81 LMNA (0.97) LMNACYP2C9KMT2AMEN1ATIC
Sulfaquinoxaline SCHEMBL301314 0.81 LMNA (0.97) LMNACYP2C9KMT2AMEN1ATIC
SCHEMBL2407197 0.77 L3MBTL1 (0.66) LMNAKMT2AMEN1MAPK1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0215200-B1 USE OF SULFANILAMIDO QUINOXALINES IN THE TREATMENT OF NEOPLASTIC DISEASES MERCK & CO. INC. (US) 1992-09-09 EP disclosed
US-4931433-A Method for treating certain neoplastic diseases MERCK & CO., INC. (US) 1990-06-05 US disclosed
EP-0215200-A2 Use of sulfanilamido quinoxalines in the treatment of neoplastic diseases MERCK & CO. INC. (US) 1987-03-25 EP disclosed