SCHEMBL8444396

SCHEMBL8444396

CS(=O)(=O)OCc1cc(C(=O)N=C(N)N)cc(-c2cccc3occc23)c1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 15/20 0.38
HTR2B P41595 2/20 0.34
HTR7 P34969 1/20 0.33

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
SCHEMBL7822636 0.78 SLC9A1 (0.40) SLC9A1HTR2BHTR7
SCHEMBL8443219 0.77 SLC9A1 (0.41) SLC9A1
SCHEMBL8444497 0.74 SLC9A1 (0.38) SLC9A1HTR2B
SCHEMBL8444393 0.70 SLC9A1 (0.32) SLC9A1
SCHEMBL8440725 0.69 CYP4F2 (0.41)
SCHEMBL7826501 0.69 SLC9A1 (0.41) SLC9A1
SCHEMBL8444450 0.66 TNKS (0.40)
SCHEMBL8442873 0.66 KEAP1 (0.43)
SCHEMBL8444494 0.65 F10 (0.36) SLC9A1
SCHEMBL8442957 0.63 CHRM2 (0.49)

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