SCHEMBL23770679

SCHEMBL23770679

Cc1ccc(F)cc1-c1nc(N[S+]([O-])c2cccc(N3CCC(C=O)C3)n2)ccc1C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TTR P02766 3/20 0.32
RBP4 P02753 2/20 0.31
ABL1 P00519 1/20 0.31
CTSS P25774 1/20 0.30
WDR5 P61964 1/20 0.30
ACACB O00763 1/20 0.30

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
SCHEMBL23770744 0.85 RAF1 (0.33) RBP4ABL1WDR5
SCHEMBL23770454 0.85 PIM1 (0.34) ABL1WDR5
SCHEMBL23770705 0.85 HRH3 (0.35) WDR5
SCHEMBL23770643 0.84 ADRB2 (0.37) ABL1WDR5
SCHEMBL23770589 0.83 WDR5 (0.31) WDR5
SCHEMBL23770795 0.81 ABL1 (0.34) ABL1WDR5
SCHEMBL23770889 0.79 WDR5 (0.31) TTRABL1WDR5
SCHEMBL23770649 0.79 PIM1 (0.34) TTRCTSS
SCHEMBL23770830 0.79 MAP4K1 (0.33) WDR5
SCHEMBL23770787 0.76 PDE10A (0.35)

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-3504194-B1 N-(PYRIDIN-2-YL)PYRIDINE-SULFONAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE NOVARTIS AG (CH) 2021-08-18 EP disclosed