SCHEMBL9833863

SCHEMBL9833863

Cc1cnc2nc(S(=O)(=O)Nc3c(C)cccc3C(=O)O)nn2c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.46
METAP2 P50579 1/20 0.38
POLB P06746 2/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 2/20 0.34
HPGD P15428 2/20 0.34
HSD17B10 Q99714 2/20 0.34
JAK2 O60674 1/20 0.34
LMNA P02545 2/20 0.33
PDE2A O00408 1/20 0.33
EDNRA P25101 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
GAA P10253 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
SCHEMBL9832148 0.90 FFAR4 (0.37) ACLYPOLBKDM4EALDH1A1HSD17B10
SCHEMBL9832072 0.90 ACLY (0.35) ACLYMETAP2POLBKDM4EALDH1A1
SCHEMBL9832083 0.90 ACLY (0.39) ACLYMETAP2HPGDLMNAMEN1
SCHEMBL9833246 0.90 ACLY (0.52) ACLYMETAP2POLBKDM4ELMNA
SCHEMBL9833898 0.87 METAP2 (0.33) ACLYMETAP2KDM4EALDH1A1HPGD
SCHEMBL9831601 0.87 LMNA (0.39) KDM4EALDH1A1HPGDHSD17B10LMNA
SCHEMBL9833225 0.87 MEN1 (0.38) ACLYALDH1A1MEN1KMT2AGAA
SCHEMBL9834365 0.86 METAP2 (0.33) ACLYMETAP2KDM4EALDH1A1PDE2A
SCHEMBL9831620 0.86 NPC1 (0.33) ACLYPOLBKDM4EALDH1A1HPGD
SCHEMBL9831767 0.85 SLC40A1 (0.31) METAP2POLB

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