SCHEMBL23267217

SCHEMBL23267217

CNC(=O)COc1cc2cc(Nc3nc(N4CCN(I)CC4)ncc3Cl)ccc2n(CCOC)c1=O

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BCL6 P41182 17/20 0.62
▸ MELK Q14680 1/20 0.62
▸ NCOR2 Q9Y618 5/20 0.61
▸ CHRM4 P08173 1/20 0.52
▸ BCL6B Q8N143 1/20 0.52
▸ HDAC3 O15379 1/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ HDAC2 Q92769 1/20 0.42
▸ MET P08581 2/20 0.40
▸ INSR P06213 1/20 0.40

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
SCHEMBL23266775 0.94 BCL6 (0.64) BCL6MELKNCOR2CHRM4BCL6B
SCHEMBL23267749 0.93 BCL6 (0.64) BCL6MELKNCOR2CHRM4BCL6B
SCHEMBL23267204 0.93 BCL6 (0.64) BCL6MELKNCOR2CHRM4BCL6B
SCHEMBL23267218 0.92 BCL6 (0.61) BCL6MELKNCOR2CHRM4BCL6B
SCHEMBL29333237 0.91 BCL6 (0.63) BCL6MELKNCOR2CHRM4BCL6B
SCHEMBL23266772 0.91 BCL6 (0.63) BCL6MELKNCOR2CHRM4BCL6B
SCHEMBL23267141 0.91 BCL6 (0.62) BCL6MELKNCOR2CHRM4BCL6B
SCHEMBL23267215 0.91 BCL6 (0.61) BCL6MELKNCOR2CHRM4BCL6B
SCHEMBL23267129 0.91 BCL6 (0.63) BCL6MELKNCOR2CHRM4BCL6B
SCHEMBL24717369 0.91 BCL6 (0.68) BCL6MELKNCOR2CHRM4BCL6B

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-2021077010-A1 BIFUNCTIONAL MOLECULES CONTAINING AN E3 UBIQUITINE LIGASE BINDING MOIETY LINKED TO A BCL6 TARGETING MOIETY ARVINAS OPERATIONS, INC. (US) 2021-04-22 — — WO disclosed
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