SCHEMBL30907643

SCHEMBL30907643

CCC(=O)c1cc(C)c(-c2cc3cnc(CC(N)=O)cc3cn2)cn1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 13/20 0.34
MAP4K1 Q92918 1/20 0.34
HTT P42858 1/20 0.32

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
SCHEMBL30907624 0.91 GABRA1 (0.35) ABL1MAP4K1HTT
SCHEMBL30907314 0.83 ABL1 (0.39) ABL1MAP4K1
SCHEMBL30907560 0.82 ABL1 (0.45) ABL1MAP4K1HTT
SCHEMBL30907248 0.78 ABL1 (0.39) ABL1MAP4K1
SCHEMBL30907267 0.78 ABL1 (0.36) ABL1MAP4K1
SCHEMBL30907127 0.77 ABL1 (0.48) ABL1MAP4K1
SCHEMBL30907640 0.76 ABL1 (0.38) ABL1
SCHEMBL30907099 0.76 ABL1 (0.35) ABL1MAP4K1
SCHEMBL30907616 0.74 ABL1 (0.50) ABL1
SCHEMBL30907615 0.74 GABRA1 (0.38) ABL1MAP4K1

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-2024097953-A1 NAPHTHYRIDINE COMPOUNDS FOR INHIBITION OF RAF KINASES ENLIVEN INC. (US) 2024-05-10 WO disclosed