SCHEMBL19404362

SCHEMBL19404362

O=C(O)c1ccc(O[C@H]2CCNC2)c(-c2ccc(F)cc2)c1

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTNNB1 P35222 20/20 0.72
▸ BCL9 O00512 19/20 0.72

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
SCHEMBL19404306 0.89 CTNNB1 (0.78) CTNNB1BCL9
SCHEMBL18165147 0.85 CTNNB1 (0.98) CTNNB1BCL9
SCHEMBL19404285 0.85 BCL9 (0.80) CTNNB1BCL9
SCHEMBL20021920 0.81 CTNNB1 (0.89) CTNNB1BCL9
SCHEMBL19404315 0.80 BCL9 (1.00) CTNNB1BCL9
SCHEMBL18165156 0.80 CTNNB1 (1.00) CTNNB1BCL9
SCHEMBL18165154 0.80 CTNNB1 (1.00) CTNNB1BCL9
SCHEMBL18165152 0.80 CTNNB1 (1.00) CTNNB1BCL9
SCHEMBL19404313 0.80 BCL9 (1.00) CTNNB1BCL9
SCHEMBL18165157 0.80 CTNNB1 (1.00) CTNNB1BCL9

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-2017165839-A1 METHODS AND COMPOSITION OF 4-SUBSTITUTED BENZOYLPIPERAZINE-1-SUBSTITUTED CARBONYLS AS BETA-CATENIN/B-CELL LYMPHOMA 9 INHIBITORS UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2017-09-28 — — WO disclosed
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