SCHEMBL9833898

SCHEMBL9833898

Cc1cnc2nc(S(=O)(=O)Nc3c(C(=O)O)ccc(C)c3C)nn2c1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.33
ACLY P53396 3/20 0.32
PDE2A O00408 1/20 0.31
ALDH1A1 P00352 2/20 0.31
PTGER4 P35408 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
HPGD P15428 1/20 0.31
CRHBP P24387 1/20 0.31
KMT2A Q03164 1/20 0.31
CRHR2 Q13324 1/20 0.31
HSD17B10 Q99714 1/20 0.31
PDCD1 Q15116 1/20 0.30
CD274 Q9NZQ7 1/20 0.30
JAK2 O60674 1/20 0.30

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
SCHEMBL9832427 0.90 ACLY (0.34) METAP2ACLYMEN1KMT2AHSD17B10
SCHEMBL9830248 0.90 MAPK14 (0.34) ALDH1A1KDM4EHSD17B10
SCHEMBL9834365 0.88 METAP2 (0.33) METAP2ACLYPDE2AALDH1A1PTGER4
SCHEMBL9833863 0.87 ACLY (0.46) METAP2ACLYPDE2AALDH1A1KDM4E
SCHEMBL9832765 0.87 LMNA (0.39) ALDH1A1KDM4EMEN1KMT2A
SCHEMBL9832670 0.86 CA12 (0.31) PDE2A
SCHEMBL9831767 0.85 SLC40A1 (0.31) METAP2
SCHEMBL9834743 0.83 CLCN2 (0.35) ACLYMEN1KMT2AHSD17B10
SCHEMBL9832072 0.83 ACLY (0.35) METAP2ACLYALDH1A1KDM4EHSD17B10
SCHEMBL9832083 0.83 ACLY (0.39) METAP2ACLYMEN1HPGDKMT2A

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
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