SCHEMBL28848869

SCHEMBL28848869

Cc1cc(-n2cnc(C3CC3)c2)cc(F)n1

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAP3K5 Q99683 20/20 0.38

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
SCHEMBL28848844 0.83 MAP3K5 (0.38) MAP3K5
SCHEMBL18027905 0.70 MAP3K5 (0.55) MAP3K5
SCHEMBL28928037 0.69 MAP3K5 (0.42) MAP3K5
SCHEMBL28660386 0.69 TTR (0.39) MAP3K5
SCHEMBL28643807 0.68 MAP3K5 (0.41) MAP3K5
SCHEMBL28658710 0.68 MAP4K4 (0.39) MAP3K5
SCHEMBL3783299 0.67 NR2E1 (0.63) MAP3K5
SCHEMBL28391289 0.67 MAP3K5 (0.53) MAP3K5
SCHEMBL17880574 0.67 MAP3K5 (0.53) MAP3K5
SCHEMBL30095423 0.67 MAP3K5 (0.45) MAP3K5

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
CN-110036005-B Amide derivatives and their use in medicine 广东东阳光药业有限公司 2022-09-27 CN disclosed