SCHEMBL30907341

SCHEMBL30907341

CC[C@H](O)c1cc(C)c(-c2cc3cnc(NC(=O)[C@H]4CC4(F)F)cc3nc2-n2cccn2)cn1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 16/20 0.47
MAP4K1 Q92918 3/20 0.36
ADORA2A P29274 1/20 0.34
ADORA2B P29275 1/20 0.34

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
SCHEMBL30907447 1.00 ABL1 (0.47) ABL1MAP4K1ADORA2AADORA2B
SCHEMBL30907181 1.00 ABL1 (0.47) ABL1MAP4K1ADORA2AADORA2B
SCHEMBL30907421 0.88 ABL1 (0.41) ABL1MAP4K1ADORA2AADORA2B
SCHEMBL30907231 0.83 ABL1 (0.53) ABL1MAP4K1
SCHEMBL30907238 0.83 ABL1 (0.53) ABL1MAP4K1
SCHEMBL30907473 0.83 ABL1 (0.53) ABL1MAP4K1
SCHEMBL30907392 0.82 ABL1 (0.51) ABL1MAP4K1
SCHEMBL30907630 0.82 ABL1 (0.51) ABL1MAP4K1
SCHEMBL30907282 0.82 ABL1 (0.51) ABL1MAP4K1
SCHEMBL30907257 0.81 ABL1 (0.51) 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