SCHEMBL7826924

SCHEMBL7826924

CS(=O)(=O)Oc1c(C(=O)N=C(N)N)cccc1-n1cccc1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 3/20 0.52
SLC9A3 P48764 1/20 0.52
SLC9A2 Q9UBY0 1/20 0.52
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL7826920 0.82 SLC9A1 (0.54) SLC9A1SLC9A3SLC9A2LMNAGAA
SCHEMBL9392969 0.78 SLC9A1 (0.48) SLC9A1SLC9A3SLC9A2LMNAGAA
SCHEMBL7825774 0.76 LMNA (0.57) SLC9A1SLC9A3SLC9A2LMNAGAA
SCHEMBL27401335 0.71 SLC9A1 (0.59) SLC9A1SLC9A3SLC9A2
SCHEMBL8704441 0.71 SLC9A1 (0.59) SLC9A1SLC9A3SLC9A2
SCHEMBL7822660 0.71 SLC9A1 (0.59) SLC9A1SLC9A3SLC9A2
SCHEMBL7823230 0.71 SLC9A1 (0.56) SLC9A1SLC9A3SLC9A2
SCHEMBL8447084 0.69 SLC9A1 (0.64) SLC9A1SLC9A3SLC9A2
Guanidine SCHEMBL8704984 0.68 KMT2A (0.38) SLC9A1SLC9A3SLC9A2LMNAGAA
Eniporide SCHEMBL29359307 0.68 SLC9A1 (1.00) SLC9A1SLC9A3SLC9A2

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
EP-0699185-A1 GUANIDINE DERIVATIVES AS INHIBITORS OF Na+ /H+ EXCHANGE IN CELLS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-03-06 EP disclosed