SCHEMBL9832731

SCHEMBL9832731

CCOCCOC(=O)c1cccc(C)c1NS(=O)(=O)c1nc2nc(C)cc(C)n2n1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.50
ALDH1A1 P00352 6/20 0.49
GAA P10253 1/20 0.49
HSD17B10 Q99714 1/20 0.49
USP2 O75604 1/20 0.47
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
GLA P06280 1/20 0.44
HPGD P15428 2/20 0.44
HTT P42858 1/20 0.44
TP53 P04637 1/20 0.44
ATM Q13315 1/20 0.42
KDM4E B2RXH2 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
ALOX15 P16050 1/20 0.39

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
SCHEMBL9831418 0.93 ALDH1A1 (0.56) TSHRALDH1A1GAAHSD17B10USP2
SCHEMBL10666605 0.89 ALDH1A1 (0.40) TSHRALDH1A1GAAHSD17B10USP2
SCHEMBL9831973 0.89 ALDH1A1 (0.49) TSHRALDH1A1GAAMEN1KMT2A
SCHEMBL8354997 0.86 TSHR (0.60) TSHRALDH1A1GAAHSD17B10USP2
SCHEMBL9831652 0.85 TSHR (0.51) TSHRALDH1A1GAAHSD17B10USP2
SCHEMBL9832814 0.85 TP53 (0.35) TSHRALDH1A1GAAHSD17B10KMT2A
SCHEMBL9832778 0.84 ALDH1A1 (0.54) TSHRALDH1A1GAAHSD17B10USP2
SCHEMBL9830824 0.84 ALDH1A1 (0.54) TSHRALDH1A1GAAHSD17B10USP2
SCHEMBL9831141 0.83 TSHR (0.54) TSHRALDH1A1GAAHSD17B10USP2
SCHEMBL9831648 0.82 TSHR (0.48) TSHRALDH1A1GAAHSD17B10USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0142152-B1 Novel substituted 1,2,4-triazolo- [1,5-a] pyrimidine-2-sulfonamides and compositions and methods of controlling undesired vegetation and suppressing the nitrification of ammonium nitrogen in soil THE DOW CHEMICAL COMPANY (US) 1991-03-20 EP claimed
EP-0142152-A2 Novel substituted 1,2,4-triazolo- [1,5-a] pyrimidine-2-sulfonamides and compositions and methods of controlling undesired vegetation and suppressing the nitrification of ammonium nitrogen in soil THE DOW CHEMICAL COMPANY (US) 1985-05-22 EP claimed
EP-0142152-B1 Novel substituted 1,2,4-triazolo- [1,5-a] pyrimidine-2-sulfonamides and compositions and methods of controlling undesired vegetation and suppressing the nitrification of ammonium nitrogen in soil THE DOW CHEMICAL COMPANY (US) 1991-03-20 EP disclosed
EP-0330137-A1 Intermediate compounds for the preparation of 1,2,4-triazolo [1,5-a]pyrimidine-2-sulfonamides DowElanco (US) 1989-08-30 EP disclosed
US-4755212-A Novel substituted 1,2,4-triazolo[1,5-a]pyrimidine-2-sulfonamides and compositions and method for inhibiting pollen formation in corn THE DOW CHEMICAL COMPANY (US) 1988-07-05 US disclosed
US-4741764-A SUPPRESSION OF NITRIFICATION OF AMMONIUM NITROGEN IN THE SOIL THE DOW CHEMICAL COMPANY (US) 1988-05-03 US disclosed
US-4740233-A Substituted 1,2,4-triazolo[1,5-a]-pyrimidine-2-sulfonamides and compositions and methods of controlling undesired vegetation and suppressing the nitrification of ammonium nitrogen in soil THE DOW CHEMICAL COMPANY (US) 1988-04-26 US disclosed
EP-0142152-A2 Novel substituted 1,2,4-triazolo- [1,5-a] pyrimidine-2-sulfonamides and compositions and methods of controlling undesired vegetation and suppressing the nitrification of ammonium nitrogen in soil THE DOW CHEMICAL COMPANY (US) 1985-05-22 EP disclosed