SCHEMBL7848907

SCHEMBL7848907

CCOc1cc(C)cc2nc(S(=O)(=O)Nc3c(C)cccc3[N+](=O)[O-])nn12

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.37
KMT2A Q03164 6/20 0.37
ALDH1A1 P00352 3/20 0.37
GAA P10253 2/20 0.37
HPGD P15428 1/20 0.36
KDM4E B2RXH2 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
NFKBIA P25963 1/20 0.34
AGTR1 P30556 1/20 0.34
OPRK1 P41145 1/20 0.34
RELA Q04206 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MAPT P10636 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
POLB P06746 1/20 0.33
PTPN1 P18031 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL7849607 0.89 NFKBIA (0.33) MEN1KMT2AALDH1A1GAAKDM4E
SCHEMBL7841680 0.84 MEN1 (0.39) MEN1KMT2AALDH1A1GAASMN1; SMN2
SCHEMBL10473579 0.82 TSHR (0.35) MEN1KMT2AALDH1A1GAAHPGD
SCHEMBL7848967 0.79 AGTR1 (0.35) MEN1KMT2AALDH1A1GAAKDM4E
SCHEMBL7851003 0.75 TSHR (0.36) MEN1KMT2A
SCHEMBL9831411 0.74 ALDH1A1 (0.41) MEN1KMT2AALDH1A1KDM4ESMN1; SMN2
SCHEMBL9835236 0.74 TSHR (0.37) MEN1KMT2AALDH1A1GAASMN1; SMN2
SCHEMBL8824776 0.73 TSHR (0.56) MEN1KMT2AALDH1A1SMN1; SMN2MAPT
SCHEMBL10475027 0.73 MEN1 (0.32) MEN1KMT2AALDH1A1GAAKDM4E
SCHEMBL10397567 0.73 TSHR (0.40) MEN1KMT2AALDH1A1GAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0717743-B1 N-ARYL 1,2,4]TRIAZOLO 1,5-a]PYRIDINE-2-SULFONAMIDE HERBICIDES DOW AGROSCIENCES LLC (US) 2001-11-14 EP disclosed
EP-0972774-A2 2-Benzylthio-8-amino(1,2,4)triazolo(1,5-pyridines Dow AgroSciences LLC (US) 2000-01-19 EP disclosed
US-5571775-A EFFECTIVE ON A BROAD SPECTRUM OF VEGETATION AT LOW APPLICATION RATES DOWELANCO (US) 1996-11-05 US disclosed
EP-0717743-A1 N-ARYL 1,2,4]TRIAZOLO 1,5-a]PYRIDINE-2-SULFONAMIDE HERBICIDES DOWELANCO (US) 1996-06-26 EP disclosed
EP-0703911-A1 SECONDARY AMINES AS ANTIDIABETIC AND ANTIOBESITY AGENTS PFIZER (US) 1996-04-03 EP disclosed
WO-1996001826-A1 N-ARYL[1,2,4]TRIAZOLO[1,5-a]PYRIDINE-2-SULFONAMIDE HERBICIDES DOWELANCO (US) 1996-01-25 WO disclosed
WO-1994029290-A1 SECONDARY AMINES AS ANTIDIABETIC AND ANTIOBESITY AGENTS PFIZER INC. (US) 1994-12-22 WO disclosed