SCHEMBL24975362

SCHEMBL24975362

CC(C)(C)OC(=O)N[C@H]1C[C@H](Oc2cc(F)c(F)c(F)c2)C1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.41
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KDM1A O60341 2/20 0.39
MAOB P27338 1/20 0.39
PIK3CD O00329 1/20 0.39
EPHX2 P34913 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
FFAR4 Q5NUL3 5/20 0.39
PARP1 P09874 1/20 0.38
GAA P10253 1/20 0.37
GPR119 Q8TDV5 1/20 0.36
CTSK P43235 2/20 0.36
FFAR1 O14842 2/20 0.35
KAT8 Q9H7Z6 1/20 0.35

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
SCHEMBL29279741 1.00 BTK (0.41) BTKKMT2AL3MBTL1KDM1AMAOB
SCHEMBL29874615 0.93 PIK3CD (0.39) BTKKMT2AL3MBTL1KDM1AMAOB
SCHEMBL28529932 0.91 BTK (0.44) BTKKMT2AL3MBTL1KDM1AMAOB
SCHEMBL28529931 0.91 BTK (0.44) BTKKMT2AL3MBTL1KDM1AMAOB
SCHEMBL21503612 0.91 BTK (0.44) BTKKMT2AL3MBTL1KDM1AMAOB
SCHEMBL29874623 0.91 PIK3CD (0.41) BTKKMT2AL3MBTL1KDM1AMAOB
SCHEMBL29874307 0.90 BTK (0.39) BTKKMT2AL3MBTL1KDM1AMAOB
SCHEMBL29874542 0.89 FFAR4 (0.39) BTKKMT2AL3MBTL1KDM1AMAOB
SCHEMBL29874277 0.88 EPHX2 (0.44) BTKKMT2AL3MBTL1KDM1AMAOB
SCHEMBL9913880 0.88 EPHX2 (0.44) BTKKMT2AL3MBTL1KDM1AMAOB

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-2023005894-A1 INHIBITOR COMPOUND FOR WNT PATHWAY 杭州阿诺生物医药科技有限公司 2023-02-02 WO disclosed