SCHEMBL21246732

SCHEMBL21246732

COc1c(F)c(B2OC(C)(C)C(C)(C)O2)cc(C(=O)NC(C)(C)CC(C)(C)C)c1OCC[Si](C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
DGAT1 O75907 1/20 0.31

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
SCHEMBL22578934 0.93 HTT (0.32) HTTSMN1; SMN2DGAT1
SCHEMBL21246765 0.93 HTT (0.32) HTTSMN1; SMN2DGAT1
SCHEMBL22578883 0.92 HTT (0.33) HTTSMN1; SMN2DGAT1
SCHEMBL21246832 0.89 LIPE (0.31) HTTSMN1; SMN2
SCHEMBL26310727 0.89 HTT (0.32) HTTSMN1; SMN2
SCHEMBL22556080 0.84 HTT (0.31) HTTSMN1; SMN2
SCHEMBL22556130 0.83 LIPE (0.33) HTTSMN1; SMN2DGAT1
SCHEMBL21246757 0.83 DGAT1 (0.34) HTTSMN1; SMN2DGAT1
SCHEMBL29750684 0.83 DGAT1 (0.34) HTTSMN1; SMN2DGAT1
SCHEMBL22556109 0.82 HTT (0.30) HTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3749672-B1 INHIBITORS OF THE BCL6 BTB DOMAIN PROTEIN-PROTEIN INTERACTION AND USES THEREOF ONTARIO INSTITUTE FOR CANCER RES OICR (CA) 2022-07-27 EP disclosed
EP-3749672-A1 INHIBITORS OF THE BCL6 BTB DOMAIN PROTEIN-PROTEIN INTERACTION AND USES THEREOF Ontario Institute for Cancer Research (OICR) (CA) 2020-12-16 EP disclosed
EP-3728267-A1 TRICYCLIC INHIBITORS OF THE BCL6 BTB DOMAIN PROTEIN-PROTEIN INTERACTION AND USES THEREOF Ontario Institute for Cancer Research (OICR) (CA) 2020-10-28 EP disclosed
WO-2019153080-A1 INHIBITORS OF THE BCL6 BTB DOMAIN PROTEIN-PROTEIN INTERACTION AND USES THEREOF ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2019-08-15 WO disclosed