SCHEMBL23266776

SCHEMBL23266776

CCCCn1c(=O)c(OCC(=O)NC)cc2cc(Nc3nc(N4CCNCC4)ncc3Cl)ccc21

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ BCL6 P41182 17/20 0.63
▸ NCOR2 Q9Y618 5/20 0.63
▸ MELK Q14680 1/20 0.62
▸ CHRM4 P08173 1/20 0.51
▸ BCL6B Q8N143 1/20 0.51
▸ ROCK2 O75116 3/20 0.47
▸ ROCK1 Q13464 1/20 0.47
▸ ADRB3 P13945 1/20 0.41
▸ HTR1D P28221 1/20 0.41
▸ ADORA1 P30542 1/20 0.41
▸ OPRM1 P35372 1/20 0.41
▸ SLC6A3 Q01959 1/20 0.41
▸ TMEM97 Q5BJF2 1/20 0.41
▸ HRH3 Q9Y5N1 1/20 0.41

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
SCHEMBL23267066 0.96 BCL6 (0.65) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL23267753 0.93 BCL6 (0.64) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL23266770 0.93 BCL6 (0.64) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL23267063 0.93 BCL6 (0.65) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL23267757 0.91 BCL6 (0.62) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL23267141 0.91 BCL6 (0.62) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL23266772 0.91 BCL6 (0.63) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL23268234 0.91 BCL6 (0.65) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL23266769 0.91 BCL6 (0.63) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL23267064 0.90 BCL6 (0.78) BCL6NCOR2MELKCHRM4BCL6B

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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