SCHEMBL8446235

SCHEMBL8446235

CS(=O)(=O)c1cc(C(=O)N=C(N)N)ccc1Oc1ccc(S(=O)(=O)NCCc2c[nH]cn2)cc1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 2/20 0.40
SLC9A2 Q9UBY0 1/20 0.39
KDM4E B2RXH2 1/20 0.37
MAPT P10636 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
Hydrochloric Acid SCHEMBL8070501 0.99 SLC9A1 (0.39) SLC9A1SLC9A2KDM4EMAPT
SCHEMBL8070556 0.89 MAPT (0.47) KDM4EMAPT
SCHEMBL8446233 0.87 MAPT (0.36) KDM4EMAPT
Hydrochloric Acid SCHEMBL8068552 0.86 MAPT (0.35) KDM4EMAPT
SCHEMBL8444778 0.80 SLC9A1 (0.50) SLC9A1
Hydrochloric Acid SCHEMBL8068489 0.79 SLC9A1 (0.49) SLC9A1
Hydrochloric Acid SCHEMBL8077076 0.78 KMT2A (0.52) SLC9A1
SCHEMBL8446349 0.76 SLC9A1 (0.53) SLC9A1SLC9A2
Hydrochloric Acid SCHEMBL8059477 0.75 SLC9A1 (0.52) SLC9A1SLC9A2
SCHEMBL8070495 0.74 KDM4E (0.67) KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0723956-B1 Basically substituted benzoylguanidines, process for their preparation, their use as medicaments or diagnostics as well as medicaments containing them HOECHST AG (DE) 1999-10-13 EP claimed