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SCHEMBL18152552

SCHEMBL18152552

CC(C)(C)OC(=O)N1CC[C@H](Oc2ccc(NC(=O)c3ccc(O[C@H]4CCN(C(=O)OC(C)(C)C)C4)c(-c4ccc(F)c(F)c4)c3)cc2Br)C1

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTNNB1 P35222 20/20 0.54
▸ BCL9 O00512 19/20 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
SCHEMBL18165188 1.00 CTNNB1 (0.54) CTNNB1BCL9
SCHEMBL20021970 0.97 CTNNB1 (0.51) CTNNB1BCL9
SCHEMBL18152317 0.91 BCL9 (0.65) CTNNB1BCL9
SCHEMBL18165168 0.91 BCL9 (0.57) CTNNB1BCL9
SCHEMBL18152550 0.91 CTNNB1 (0.46) CTNNB1BCL9
SCHEMBL18152555 0.91 CTNNB1 (0.46) CTNNB1BCL9
SCHEMBL18152553 0.91 CTNNB1 (0.46) CTNNB1BCL9
SCHEMBL18152315 0.90 BCL9 (0.64) CTNNB1BCL9
SCHEMBL18165192 0.89 CTNNB1 (0.53) CTNNB1BCL9
SCHEMBL18152349 0.89 BCL9 (0.66) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016168524-A1 SUBSTITUTED N-([1,1'-BIPHENYL]-3-YL)-[1,1'-BIPHENYL]-3-CARBOXAMIDE ANALOGS AS INHIBITORS FOR BETA-CATENIN/B-CELL LYMPHOMA 9 INTERACTIONS UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2016-10-20 — — WO disclosed
WO-2016168524-A1 SUBSTITUTED N-([1,1'-BIPHENYL]-3-YL)-[1,1'-BIPHENYL]-3-CARBOXAMIDE ANALOGS AS INHIBITORS FOR BETA-CATENIN/B-CELL LYMPHOMA 9 INTERACTIONS UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2016-10-20 — — WO disclosed