SCHEMBL30907396

SCHEMBL30907396

CC[C@H](O)c1cc(C)c(-c2cc3cnc(NC(=O)[C@H]4CC4(F)F)cc3nc2C(=O)NC)cn1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 17/20 0.51
MAP4K1 Q92918 1/20 0.37
JAK2 O60674 2/20 0.36
TYK2 P29597 1/20 0.36

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
SCHEMBL30907513 1.00 ABL1 (0.51) ABL1MAP4K1JAK2TYK2
SCHEMBL30907257 1.00 ABL1 (0.51) ABL1MAP4K1JAK2TYK2
SCHEMBL30907630 0.91 ABL1 (0.51) ABL1MAP4K1
SCHEMBL30907282 0.91 ABL1 (0.51) ABL1MAP4K1
SCHEMBL30907392 0.91 ABL1 (0.51) ABL1MAP4K1
SCHEMBL30907309 0.89 ABL1 (0.50) ABL1MAP4K1
SCHEMBL30907479 0.89 ABL1 (0.50) ABL1MAP4K1
SCHEMBL30907419 0.89 ABL1 (0.50) ABL1MAP4K1
SCHEMBL30907473 0.87 ABL1 (0.53) ABL1MAP4K1
SCHEMBL30907231 0.87 ABL1 (0.53) 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