SCHEMBL22421714

SCHEMBL22421714

Cn1c(=O)c(OCC(=O)O)cc2cc(Nc3nc(N4CCC5(CCCCC5)CC4)ncc3O)ccc21

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ BCL6 P41182 20/20 0.52
▸ NCOR2 Q9Y618 5/20 0.52
▸ MELK Q14680 1/20 0.52
▸ CHRM4 P08173 1/20 0.40
▸ BCL6B Q8N143 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
SCHEMBL20284711 0.92 BCL6 (0.63) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL20284377 0.81 BCL6 (0.65) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL20284524 0.81 BCL6 (0.61) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL20284211 0.81 BCL6 (0.76) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL20284721 0.79 BCL6 (0.74) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL20284386 0.78 BCL6 (0.72) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL20284569 0.78 BCL6 (0.68) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL20284525 0.78 BCL6 (0.62) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL20284527 0.78 BCL6 (0.64) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL20284526 0.78 BCL6 (0.66) 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
EP-3555063-B1 6-AMINO-QUINOLINONE COMPOUNDS AND DERIVATIVES AS BCL6 INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2020-09-16 — — EP disclosed
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