SCHEMBL29874016

SCHEMBL29874016

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCL6 P41182 4/20 0.40
▸ BCOR Q6W2J9 4/20 0.40
▸ MAPT P10636 4/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ GABRG2 P18507 1/20 0.38
▸ GABRB3 P28472 1/20 0.38
▸ GABRA5 P31644 1/20 0.38
▸ TRIM24 O15164 3/20 0.38
▸ MAPK1 P28482 1/20 0.37
▸ SYK P43405 1/20 0.35
▸ BRD4 O60885 1/20 0.35
▸ CREBBP Q92793 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ INSR P06213 2/20 0.34
▸ ALK Q9UM73 2/20 0.34
▸ IDH1 O75874 1/20 0.34
▸ ALDH1A3 P47895 1/20 0.34
▸ F11 P03951 1/20 0.34

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
SCHEMBL23249920 1.00 BCL6 (0.40) BCL6BCORMAPTALDH1A1MEN1
SCHEMBL23249944 0.87 BCL6 (0.39) BCL6BCORMAPTALDH1A1MEN1
SCHEMBL29874089 0.87 BCL6 (0.39) BCL6BCORMAPTALDH1A1MEN1
SCHEMBL23267269 0.83 BCL6 (0.37) BCL6BCORMAPTALDH1A1MEN1
SCHEMBL31595469 0.73 CRBN (0.50) ALK
SCHEMBL31595459 0.71 MAPT (0.41) BCL6BCORMAPT
SCHEMBL31735584 0.63 BPTF (0.68) GABRG2GABRB3GABRA5BRD4CREBBP
SCHEMBL24865338 0.63 TRIM24 (0.42) BCL6GABRG2GABRB3GABRA5TRIM24
SCHEMBL3041124 0.62 SIRT2 (0.63) ALDH1A1MEN1KMT2AGABRG2GABRB3
SCHEMBL31444679 0.62 INSR (0.56) GABRG2GABRB3GABRA5TRIM24SYK

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119019369-A Bifunctional molecules comprising an E3 ubiquitin ligase binding moiety linked to a BCL6 targeting moiety 阿尔维纳斯运营股份有限公司 2024-11-26 — — CN disclosed
CN-115397821-B Bifunctional molecules comprising an E3 ubiquitin ligase binding moiety linked to a BCL6 targeting moiety 阿尔维纳斯运营股份有限公司 2024-09-03 — — CN disclosed
EP-4045496-A1 BIFUNCTIONAL MOLECULES CONTAINING AN E3 UBIQUITINE LIGASE BINDING MOIETY LINKED TO A BCL6 TARGETING MOIETY Arvinas Operations, Inc. (US) 2022-08-24 — — EP disclosed
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