SCHEMBL23267269

SCHEMBL23267269

CN1C(=O)CCc2cc(Nc3cc(N4CCC(CN(C)C5CCC5)CC4)c([N+](=O)[O-])cc3Cl)ccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCL6 P41182 4/20 0.37
▸ BCOR Q6W2J9 4/20 0.37
▸ GABRG2 P18507 1/20 0.36
▸ GABRB3 P28472 1/20 0.36
▸ GABRA5 P31644 1/20 0.36
▸ TRIM24 O15164 2/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ MAPT P10636 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ NOS3 P29474 1/20 0.35
▸ NOS1 P29475 1/20 0.35
▸ NOS2 P35228 1/20 0.35
▸ MAPK1 P28482 1/20 0.34
▸ INSR P06213 4/20 0.34
▸ MET P08581 2/20 0.34
▸ SYK P43405 1/20 0.34
▸ ALK Q9UM73 3/20 0.33
▸ IDH1 O75874 1/20 0.33

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
SCHEMBL23249944 0.87 BCL6 (0.39) BCL6BCORGABRG2GABRB3GABRA5
SCHEMBL29874089 0.87 BCL6 (0.39) BCL6BCORGABRG2GABRB3GABRA5
SCHEMBL29874016 0.83 BCL6 (0.40) BCL6BCORGABRG2GABRB3GABRA5
SCHEMBL23249920 0.83 BCL6 (0.40) BCL6BCORGABRG2GABRB3GABRA5
SCHEMBL23249934 0.81 CRBN (0.38) BCL6BCOR
SCHEMBL23249931 0.81 CRBN (0.38) BCL6BCOR
SCHEMBL23249988 0.76 CRBN (0.37) BCL6BCOR
SCHEMBL31595469 0.73 CRBN (0.50) ALK
SCHEMBL31595459 0.68 MAPT (0.41) BCL6BCORMAPT
SCHEMBL22955126 0.60 SMN1; SMN2 (0.49) SMN1; SMN2MAPTALDH1A1MEN1KMT2A

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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