Sugi Predict

Sugi Predict / Compounds / SCHEMBL23266372

SCHEMBL23266372

SCHEMBL23266372

CNC(=O)COc1cc2cc(Nc3nc(N4CCC(OC5CN(c6ccc7c(c6)C(=O)N(C6CCC(=O)NC6=O)C7=O)C5)CC4)ncc3Cl)ccc2n(C)c1=O

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BCL6 P41182 9/20 0.59
▸ NCOR2 Q9Y618 4/20 0.59
▸ MELK Q14680 1/20 0.58
▸ CHRM4 P08173 1/20 0.47
▸ BCL6B Q8N143 1/20 0.47
▸ PTK2 Q05397 5/20 0.47
▸ EGFR P00533 3/20 0.42
▸ ALK Q9UM73 2/20 0.41
▸ BTK Q06187 1/20 0.41
▸ ERBB2 P04626 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
SCHEMBL31595237 1.00 BCL6 (0.59) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL31595441 0.97 BCL6 (0.59) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL31595516 0.96 BCL6 (0.58) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL31595569 0.96 BCL6 (0.58) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL31595510 0.95 BCL6 (0.52) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL23267287 0.93 BCL6 (0.54) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL31595317 0.93 BCL6 (0.54) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL23249921 0.92 BCL6 (0.52) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL29874146 0.92 BCL6 (0.52) BCL6NCOR2MELKCHRM4BCL6B
SCHEMBL23266330 0.92 BCL6 (0.61) 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
Send feedback