SCHEMBL19791965

SCHEMBL19791965

CC(=O)c1ccn(S(N)(=O)=O)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.60
ALDH1A1 P00352 2/20 0.57
STS P08842 1/20 0.42
CA2 P00918 5/20 0.37
CA12 O43570 3/20 0.37
CA1 P00915 3/20 0.37
CA9 Q16790 3/20 0.37
LMNA P02545 2/20 0.36
HPGD P15428 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NPC1 O15118 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KMT2A Q03164 2/20 0.34
TUBB4A P04350 1/20 0.34
TUBB P07437 1/20 0.34
TUBA3C P0DPH7 1/20 0.34
TUBA1B P68363 1/20 0.34
TUBA4A P68366 1/20 0.34

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
SCHEMBL23705578 0.82 PKM (0.62) PKMALDH1A1STSLMNAHPGD
SCHEMBL19791804 0.80 FBP1 (0.47) PKMALDH1A1STSCA2CA12
SCHEMBL19791849 0.77 CES1 (0.41) PKMALDH1A1CA2CA12CA1
SCHEMBL19791803 0.77 CA2 (0.56) PKMALDH1A1STSCA2CA12
SCHEMBL1366438 0.75 PKM (1.00) PKMALDH1A1CA12CA9LMNA
SCHEMBL4513102 0.74 ALDH1A1 (0.75) PKMALDH1A1CA2CA1LMNA
SCHEMBL6898963 0.72 PKM (0.50) PKMALDH1A1LMNAMAPTKMT2A
SCHEMBL9918671 0.71
SCHEMBL22306542 0.69 PKM (0.44) PKMALDH1A1CA2CA12CA1
SCHEMBL28865400 0.68 ALDH1A1 (0.40) PKMALDH1A1CA2CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018015445-A1 SULFONYL UREA DERIVATIVES AND THEIR USE IN THE CONTROL OF INTERLEUKIN-1 ACTIVITY NodThera Limited (GB) 2018-01-25 WO disclosed
EP-3272739-A1 SULFONYL UREA DERIVATIVES AND THEIR USE IN THE CONTROL OF INTERLEUKIN-1 ACTIVITY NodThera Limited (GB) 2018-01-24 EP disclosed
EP-3272739-A1 SULFONYL UREA DERIVATIVES AND THEIR USE IN THE CONTROL OF INTERLEUKIN-1 ACTIVITY NodThera Limited (GB) 2018-01-24 EP disclosed