SCHEMBL7826501

SCHEMBL7826501

CS(=O)(=O)OCc1cc(C(=O)N=C(N)N)cc(-n2cccc2)c1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 3/20 0.41
SLC9A2 Q9UBY0 2/20 0.41
SLC9A3 P48764 1/20 0.41
MRGPRX4 Q96LA9 1/20 0.36
AOC2 O75106 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
Hydrochloric Acid SCHEMBL7825948 0.84 HTR7 (0.40) SLC9A1SLC9A2SLC9A3MRGPRX4AOC2
SCHEMBL7826496 0.83 SLC9A1 (0.43) SLC9A1SLC9A2SLC9A3AOC2
SCHEMBL29406734 0.83 SLC9A1 (0.43) SLC9A1SLC9A2SLC9A3AOC2
SCHEMBL1388039 0.80 VHL (0.40) SLC9A1SLC9A2SLC9A3MRGPRX4AOC2
Hydrochloric Acid SCHEMBL7826502 0.79 VHL (0.39) SLC9A1SLC9A2SLC9A3MRGPRX4AOC2
SCHEMBL1388080 0.78 SLC9A1 (0.43) SLC9A1SLC9A2SLC9A3AOC2
SCHEMBL7822725 0.78 SLC9A1 (0.49) SLC9A1SLC9A2SLC9A3
SCHEMBL7822636 0.78 SLC9A1 (0.40) SLC9A1SLC9A2
Hydrochloric Acid SCHEMBL7822462 0.77 SLC9A1 (0.36) SLC9A1SLC9A2SLC9A3MRGPRX4AOC2
Hydrochloric Acid SCHEMBL27383698 0.77 SLC9A1 (0.36) SLC9A1SLC9A2SLC9A3MRGPRX4AOC2

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-0699185-B1 GUANIDINE DERIVATIVES AS INHIBITORS OF Na+ /H+ EXCHANGE IN CELLS FUJISAWA PHARMACEUTICAL CO (JP) 2001-09-05 EP disclosed
WO-1994026709-A1 GUANIDINE DERIVATIVES AS INHIBITORS OF Na+/H+ EXCHANGE IN CELLS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-11-24 WO disclosed