SCHEMBL8440927

SCHEMBL8440927

CS(=O)(=O)ONC(N)=NC(=O)c1cccc(-c2csc3ccccc23)c1

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 1/20 0.46
SLC9A1 P19634 17/20 0.41
ERN1 O75460 2/20 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
SCHEMBL8440989 0.88 SLC9A1 (0.43) SLC9A1
SCHEMBL8803182 0.81 HDAC2 (0.50) HDAC2SLC9A1ERN1
SCHEMBL8440952 0.80 SLC9A1 (0.42) SLC9A1
SCHEMBL8441632 0.80 BCAT2 (0.37) SLC9A1
SCHEMBL8444041 0.80 CA12 (0.37) SLC9A1
SCHEMBL8442629 0.78 CA12 (0.35) SLC9A1
SCHEMBL8443930 0.78 SLC9A1 (0.40) SLC9A1
SCHEMBL8440628 0.78 SLC9A1 (0.40) SLC9A1
SCHEMBL8442896 0.78 CDK5 (0.40)
SCHEMBL8441543 0.77 SLC9A1 (0.34) SLC9A1

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
US-5968985-A INHIBITORS OF SODIUM ION/HYDROGEN ION EXCHANGE IN CELLS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-10-19 US disclosed