SCHEMBL23469950

SCHEMBL23469950

C/C(=C\c1cc(F)c(Oc2ccc(S(=O)(=O)NCCN3CCN(CCN)CC3)cc2)c(F)c1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ SLC9A3 P48764 13/20 0.57

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
SCHEMBL13286051 0.96 SLC9A3 (0.56) SLC9A3
SCHEMBL19593602 0.89 SLC9A3 (0.73) SLC9A3
SCHEMBL13286045 0.86 SLC9A3 (0.73) SLC9A3
SCHEMBL13286048 0.86 SLC9A3 (0.53) SLC9A3
SCHEMBL2580547 0.85 SLC9A3 (0.61) SLC9A3
SCHEMBL2580551 0.85 SLC9A3 (0.61) SLC9A3
SCHEMBL2570705 0.84 SLC9A3 (0.69) SLC9A3
SCHEMBL13276313 0.84 SLC9A3 (0.69) SLC9A3
SCHEMBL2571112 0.83 SLC9A3 (0.79) SLC9A3
SCHEMBL2571107 0.83 SLC9A3 (0.79) SLC9A3

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-3939964-A1 COMBINATIONS FOR INHIBITING NHE-MEDIATED ANTIPORT IN THE TREATMENT OF DISORDERS ASSOCIATED WITH FLUID RETENTION OR SALT OVERLOAD AND GASTROINTESTINAL TRACT DISORDERS Ardelyx, Inc. (US) 2022-01-19 — — EP disclosed
EP-3351248-B1 COMPOUNDS AND METHODS FOR INHIBITING NHE-MEDIATED ANTIPORT IN THE TREATMENT OF DISORDERS ASSOCIATED WITH FLUID RETENTION OR SALT OVERLOAD AND GASTROINTESTINAL TRACT DISORDERS ARDELYX INC (US) 2021-06-09 — — EP disclosed
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