SCHEMBL9833225

SCHEMBL9833225

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

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 1/20 0.38
DHODH Q02127 2/20 0.37
HDAC6 Q9UBN7 1/20 0.37
TAS2R14 Q9NYV8 1/20 0.36
RBP4 P02753 1/20 0.34
SORT1 Q99523 1/20 0.34
ACLY P53396 1/20 0.33
SLC22A12 Q96S37 2/20 0.33
PIK3CD O00329 1/20 0.33
PIK3C2B O00750 1/20 0.33
MTOR P42345 1/20 0.33
PIK3CG P48736 1/20 0.33
P2RX7 Q99572 1/20 0.32
BCL2L1 Q07817 1/20 0.32
MCL1 Q07820 1/20 0.32
GAA P10253 1/20 0.32
KAT6A Q92794 1/20 0.32

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
SCHEMBL9831264 0.91 ABL1 (0.36) ALDH1A1RBP4GAA
SCHEMBL9832480 0.88 MAPT (0.39) KMT2AALDH1A1
SCHEMBL9832409 0.87 GPR139 (0.33) SLC22A12
SCHEMBL9832072 0.87 ACLY (0.35) ALDH1A1DHODHACLYGAAKAT6A
SCHEMBL9833863 0.87 ACLY (0.46) MEN1KMT2AALDH1A1ACLYGAA
SCHEMBL9831638 0.87 SLC22A12 (0.35) MEN1KMT2ASLC22A12
SCHEMBL9832055 0.86 SLC22A12 (0.35) MEN1KMT2ASLC22A12
SCHEMBL9832083 0.85 ACLY (0.39) MEN1KMT2ADHODHSORT1ACLY
SCHEMBL10665482 0.83 SLC22A12 (0.38) SLC22A12
SCHEMBL9831887 0.82 MEN1 (0.39) MEN1KMT2AALDH1A1DHODHHDAC6

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