SCHEMBL24378719

SCHEMBL24378719

CN(C)S(=O)(=O)N=C(N)N

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F2 P00734 17/20 1.00
PRSS1 P07477 17/20 1.00
PRSS2 P07478 17/20 1.00
PRSS3 P35030 17/20 1.00
BLM P54132 1/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.32
AGO2 Q9UKV8 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32

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
SCHEMBL7088981 0.67
SCHEMBL614082 0.63
SCHEMBL41865 0.63
SCHEMBL2565951 0.63
SCHEMBL7403339 0.63
SCHEMBL13449747 0.61 F2 (0.56) F2PRSS1PRSS2PRSS3BLM
SCHEMBL20953594 0.61 F2 (0.44) F2PRSS1PRSS2PRSS3BLM
SCHEMBL14036407 0.61
Acetamide SCHEMBL28743112 0.59 LMNA (0.50) F2PRSS1PRSS2PRSS3BLM
SCHEMBL28611906 0.59

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-3988120-A1 NHE3-BINDING COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT Ardelyx, Inc. (US) 2022-04-27 EP disclosed