SCHEMBL8444342

SCHEMBL8444342

CS(=O)(=O)ONC(N)=NC(=O)c1cccc(-c2c(C(F)F)oc3ccccc23)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 1/20 0.37
PTPN1 P18031 3/20 0.32
MEN1 O00255 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
MAPK10 P53779 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HSD17B10 Q99714 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
PTGS2 P35354 2/20 0.32
PIK3CD O00329 1/20 0.32
PIK3CG P48736 1/20 0.32
SLC9A1 P19634 3/20 0.31
TERT O14746 1/20 0.31
PTGS1 P23219 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL8444435 0.87 HTR2B (0.39) HTR2BPTPN1MEN1HPGDTSHR
SCHEMBL8443921 0.86 HTR2B (0.39) HTR2BPTPN1MEN1HPGDTSHR
SCHEMBL8441028 0.83 SLC9A1 (0.38) HTR2BSLC9A1
SCHEMBL8443424 0.80 SLC9A1 (0.33) HTR2BSLC9A1CA1CA2
SCHEMBL8443930 0.80 SLC9A1 (0.40) SLC9A1
SCHEMBL8444338 0.77 MEN1 (0.36) PTPN1MEN1HPGDTSHRMAPK10
SCHEMBL8442828 0.77 TNKS (0.46) MEN1KMT2ACA1CA2ALDH1A1
SCHEMBL8440952 0.75 SLC9A1 (0.42) SLC9A1
SCHEMBL8444497 0.74 SLC9A1 (0.38) HTR2BSLC9A1CA1CA2
SCHEMBL8441543 0.74 SLC9A1 (0.34) SLC9A1CA1CA2

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 3 patents. 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
EP-0773927-A2 BENZOYLGUANIDINE DERIVATIVES AS MEDICAMENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-05-21 EP disclosed
WO-1996004241-A2 BENZOYLGUANIDINE DERIVATIVES AS MEDICAMENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-02-15 WO disclosed