SCHEMBL2740967

SCHEMBL2740967

CC(=O)Nc1ccc(S(=O)(=O)NNc2ccc([N+](=O)[O-])cc2S(=O)(=O)Nc2ccccc2Cl)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.52
▸ MEN1 O00255 4/20 0.52
▸ ALDH1A1 P00352 4/20 0.52
▸ KDM4E B2RXH2 3/20 0.52
▸ HPGD P15428 3/20 0.52
▸ TDP1 Q9NUW8 2/20 0.52
▸ CYP3A4 P08684 1/20 0.52
▸ POLB P06746 3/20 0.51
▸ CRHBP P24387 1/20 0.51
▸ CRHR2 Q13324 1/20 0.51
▸ IDO1 P14902 7/20 0.50
▸ GAA P10253 3/20 0.49
▸ MAPT P10636 5/20 0.49
▸ ALOX12 P18054 2/20 0.49
▸ MAPK1 P28482 2/20 0.49
▸ MCL1 Q07820 2/20 0.49
▸ HTT P42858 1/20 0.49
▸ THRB P10828 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ SMN1; SMN2 Q16637 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
SCHEMBL2740965 0.89 CRHBP (0.53) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL2740966 0.86 CRHBP (0.57) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL2740946 0.86 CRHBP (0.59) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL2740994 0.82 L3MBTL1 (0.59) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL6351422 0.78 HTT (0.67) KMT2AMEN1GAAHTTLMNA
SCHEMBL13128926 0.77 IDO1 (0.57) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL2741012 0.76 CRHBP (0.53) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL2740998 0.75 CRHBP (0.60) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL2740971 0.75 CRHBP (0.49) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL15647549 0.74 NFKBIA (0.61) KMT2AMEN1ALDH1A1KDM4ECYP3A4

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
US-8088772-B2 Sulfonamides and their use as a medicament THE GENETICS COMPANY, INC. (CH) 2012-01-03 — — US disclosed
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