SCHEMBL31662098

SCHEMBL31662098

C#Cc1c(F)ccc2cc(OCOC)cc(-c3nc(OC)c4c(NCC(C)C#N)nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3F)c12

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KRAS P01116 18/20 0.50
MAPK3 P27361 3/20 0.50
MAPK1 P28482 3/20 0.50
RAF1 P04049 1/20 0.47

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
SCHEMBL31662206 0.92 KRAS (0.60) KRASMAPK3MAPK1RAF1
SCHEMBL31348565 0.87 KRAS (0.58) KRASMAPK3MAPK1RAF1
SCHEMBL31662044 0.87 KRAS (0.58) KRASMAPK3MAPK1RAF1
SCHEMBL31662268 0.87 KRAS (0.50) KRASMAPK3MAPK1RAF1
SCHEMBL30702938 0.86 KRAS (0.58) KRASMAPK3MAPK1RAF1
SCHEMBL30702897 0.86 KRAS (0.57) KRASMAPK3MAPK1RAF1
SCHEMBL31348400 0.86 KRAS (0.60) KRASMAPK3MAPK1RAF1
SCHEMBL30810145 0.83 KRAS (0.57) KRASMAPK3MAPK1RAF1
SCHEMBL27243469 0.83 KRAS (0.57) KRASMAPK3MAPK1RAF1
SCHEMBL31662374 0.83 KRAS (0.46) KRASMAPK3MAPK1RAF1

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
WO-2025151594-A1 FUSED AZINES AS RAS INHIBITORS AND METHODS OF USE THEREOF KESTREL THERAPEUTICS INC. (US) 2025-07-17 WO disclosed