SCHEMBL8104315

SCHEMBL8104315

CS(=O)(=O)c1cc(C(=O)N=C(N)N)ccc1CCC(F)(F)F

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 4/20 0.56
SLC9A2 Q9UBY0 1/20 0.56

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 SCHEMBL8097803 0.99 SLC9A1 (0.55) SLC9A1SLC9A2
SCHEMBL8743800 0.84 SLC9A1 (0.57) SLC9A1SLC9A2
Hydrochloric Acid SCHEMBL8813217 0.83 SLC9A1 (0.63) SLC9A1SLC9A2
Hydrochloric Acid SCHEMBL8743802 0.82 SLC9A1 (0.56) SLC9A1SLC9A2
SCHEMBL7800762 0.81 SLC9A1 (0.55) SLC9A1SLC9A2
SCHEMBL7800759 0.81 SLC9A1 (0.55) SLC9A1SLC9A2
SCHEMBL7798673 0.81 SLC9A1 (0.55) SLC9A1SLC9A2
Hydrochloric Acid SCHEMBL8896881 0.81 SLC9A1 (0.54) SLC9A1SLC9A2
SCHEMBL8104313 0.80 EPHX2 (0.41) SLC9A1SLC9A2
SCHEMBL7798617 0.80 SLC9A1 (0.53) SLC9A1SLC9A2

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-0702001-B1 Trifluoro-propyl-substituted benzoylguanidinens and their use as medicament or diagnostic agent HOECHST AG (DE) 2000-08-23 EP claimed
US-5869531-A NO UNDESIREABLE SALIDIURETIC PROPERTIES; TREATING ISCHEMIA INDUCED DISORDERS HOECHST AKTIENGESELLSCHAFT (DE) 1999-02-09 US disclosed