SCHEMBL25522059

SCHEMBL25522059

CC(C)c1ncc(-c2ccc3ncnc(N)c3c2)cc1O

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MAP4K4 O95819 20/20 0.54

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
SCHEMBL25521671 0.83 MAP4K4 (0.58) MAP4K4
SCHEMBL17665805 0.80 MAP4K4 (0.61) MAP4K4
SCHEMBL17665854 0.80 MAP4K4 (0.62) MAP4K4
SCHEMBL17665801 0.78 MAP4K4 (0.66) MAP4K4
SCHEMBL25523900 0.77 RAF1 (0.39) —
SCHEMBL17665820 0.76 MAP4K4 (0.64) MAP4K4
SCHEMBL25522057 0.75 TGFBR1 (0.40) —
SCHEMBL25524007 0.75 PDGFRB (0.40) MAP4K4
SCHEMBL25523956 0.75 MAPKAPK2 (0.44) —
SCHEMBL19398272 0.74 MAP4K4 (0.68) MAP4K4

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-2023086428-A2 NOVEL MODULATORS OF THE ARYL HYDROCARBON RECEPTOR AND METHODS OF USE THEREOF ALLIANTHERA (SUZHOU) BIOPHARMACEUTICAL CO., LTD. (CN) 2023-05-19 — — WO disclosed
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