SCHEMBL4697645

SCHEMBL4697645

CCn1ncc(C(=O)c2ccc(S(=O)(=O)CC)c(C3=NOCC3)c2C)c1O

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.32
ALDH1A1 P00352 2/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 2/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2C19 P33261 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
SCHEMBL702111 0.92 SMN1; SMN2 (0.32) SMN1; SMN2ALDH1A1GAAHTTRAB9A
SCHEMBL4267215 0.83 RAB9A (0.32) SMN1; SMN2RAB9A
Topramezone SCHEMBL116121 0.79
Topramezone SCHEMBL29566850 0.79
SCHEMBL6969239 0.78
SCHEMBL10872717 0.77 LMNA (0.38) SMN1; SMN2ALDH1A1GAAHTTRAB9A
SCHEMBL6605808 0.75 HDAC9 (0.31)
SCHEMBL4702536 0.74 NPC1 (0.32) SMN1; SMN2RAB9A
SCHEMBL28008119 0.74 NPC1 (0.30) RAB9A
SCHEMBL7690468 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1031573-B2 USE OF A BENZOYLPYRAZOLE COMPOUND AS HERBICIDE NIPPON SODA CO (JP) 2015-05-27 EP disclosed
EP-1031573-B1 NOVEL BENZOYLPYRAZOLE COMPOUNDS, INTERMEDIATES, AND HERBICIDES NIPPON SODA CO (JP) 2008-03-26 EP disclosed