SCHEMBL23770447

SCHEMBL23770447

Cc1ccc(F)cc1-c1nc(NSc2ccnc(N3CC(C)(O)C3)c2)ccc1C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 5/20 0.34
RAF1 P04049 8/20 0.34
BRAF P15056 8/20 0.34
ABL1 P00519 7/20 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
SCHEMBL23770583 0.87 RAF1 (0.36) SOS1RAF1BRAFABL1
SCHEMBL23770596 0.85 ADRB1 (0.41) SOS1RAF1BRAFABL1
SCHEMBL19925583 0.83 SCN9A (0.37) SOS1RAF1BRAFABL1
SCHEMBL23770773 0.81 ABL1 (0.37) ABL1
SCHEMBL23770701 0.78 ATR (0.42) RAF1BRAF
SCHEMBL23770866 0.78 SOS1 (0.34) SOS1RAF1BRAF
SCHEMBL23770607 0.75 JAK2 (0.35) ABL1
SCHEMBL19925208 0.75 KIF18A (0.36) SOS1RAF1BRAFABL1
SCHEMBL23770677 0.75 ABL1 (0.36) RAF1BRAFABL1
SCHEMBL23770587 0.73 ABL1 (0.39) ABL1

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