SCHEMBL29356205

SCHEMBL29356205

CSc1ncc2cc(-c3ccc(NS(=O)(=O)Cc4ccccc4)c(F)c3F)c(=O)n(C)c2n1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BRAF P15056 10/20 0.49
FGFR1 P11362 1/20 0.41
WEE1 P30291 2/20 0.40
ABL1 P00519 5/20 0.40
RIPK2 O43353 1/20 0.37
NOD2 Q9HC29 1/20 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
SCHEMBL22190845 1.00 BRAF (0.49) BRAFFGFR1WEE1ABL1RIPK2
SCHEMBL29356085 0.88 ERN1 (0.39) BRAF
SCHEMBL22191604 0.88 ERN1 (0.39) BRAF
SCHEMBL25034178 0.88 BRAF (0.62) BRAFFGFR1ABL1
SCHEMBL29353158 0.87 ERN1 (0.39) BRAF
SCHEMBL22191003 0.87 ERN1 (0.39) BRAF
SCHEMBL22190874 0.87 BRAF (0.50) BRAFFGFR1WEE1ABL1RIPK2
SCHEMBL29357737 0.87 BRAF (0.50) BRAFFGFR1WEE1ABL1RIPK2
SCHEMBL22200682 0.84 FGFR1 (0.44) BRAFFGFR1WEE1ABL1
SCHEMBL25035602 0.78 BRAF (0.49) BRAF

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-3941919-A1 PYRIDO-PYRIMIDINONE AND PTERIDINONE COMPOUNDS AS INHIBITORS OF ENDORIBONUCLEASE INOSITOL REQUIRING ENZYME I (IRE I ALPHA) FOR THE TREATMENT OF CANCER DISEASES Genentech, Inc. (US) 2022-01-26 EP disclosed