SCHEMBL23266772

SCHEMBL23266772

CNC(=O)COc1cc2cc(Nc3nc(N4CCNCC4)ncc3Cl)ccc2n(CCOC)c1=O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCL6 P41182 15/20 0.63
▸ NCOR2 Q9Y618 5/20 0.63
▸ MELK Q14680 1/20 0.62
▸ CHRM4 P08173 1/20 0.52
▸ BCL6B Q8N143 1/20 0.52
▸ ROCK2 O75116 2/20 0.47
▸ ROCK1 Q13464 1/20 0.47
▸ ALDH1A1 P00352 3/20 0.45
▸ CYP1A2 P05177 3/20 0.45
▸ CASP1 P29466 3/20 0.45
▸ CASP7 P55210 3/20 0.45
▸ HSD17B10 Q99714 3/20 0.45
▸ CYP3A4 P08684 2/20 0.45
▸ CYP2C9 P11712 2/20 0.45
▸ HIF1A Q16665 2/20 0.45
▸ USP2 O75604 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ HPGD P15428 2/20 0.44

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
SCHEMBL23267749 0.93 BCL6 (0.64) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL23266775 0.93 BCL6 (0.64) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL23267066 0.93 BCL6 (0.65) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL23266776 0.91 BCL6 (0.63) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL23267217 0.91 BCL6 (0.62) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL23267063 0.91 BCL6 (0.65) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL24717369 0.91 BCL6 (0.68) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL23267218 0.91 BCL6 (0.61) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL23266769 0.91 BCL6 (0.63) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL23268234 0.91 BCL6 (0.65) 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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