SCHEMBL21246838

SCHEMBL21246838

CC(C)(C)CC(C)(C)NC(=O)c1cc(Br)cc(Cl)c1OCC[Si](C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.36
KDM4E B2RXH2 4/20 0.35
POLB P06746 2/20 0.35
CNR2 P34972 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
ALDH1A1 P00352 2/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2D6 P10635 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HTT P42858 1/20 0.33
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.32
RAB9A P51151 1/20 0.32
CXCR2 P25025 1/20 0.32
TSHR P16473 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
SCHEMBL21262548 0.87 POLB (0.35) KDM4EPOLBSMN1; SMN2HTTCXCR2
SCHEMBL22569468 0.82 POLB (0.42) POLBCNR2SMN1; SMN2ALDH1A1HTT
SCHEMBL22578993 0.82 SMN1; SMN2 (0.34) KDM4EPOLBCNR2SMN1; SMN2ALDH1A1
SCHEMBL21246816 0.81 AAK1 (0.38) POLBSMN1; SMN2HTT
SCHEMBL22578870 0.80 SMN1; SMN2 (0.35) HPGDPOLBSMN1; SMN2ALDH1A1HTT
SCHEMBL22578995 0.78 MAPT (0.34) POLBSMN1; SMN2ALDH1A1HTTLMNA
SCHEMBL21246662 0.78 POLB (0.33) POLBSMN1; SMN2HTT
SCHEMBL26310537 0.76 POLB (0.43) HPGDKDM4EPOLBSMN1; SMN2ALDH1A1
SCHEMBL22556084 0.76 CXCR2 (0.41) POLBSMN1; SMN2HTTCXCR2
SCHEMBL22556143 0.73 POLB (0.39) POLBSMN1; SMN2HTTCXCR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3728267-B1 TRICYCLIC INHIBITORS OF THE BCL6 BTB DOMAIN PROTEIN-PROTEIN INTERACTION AND USES THEREOF ONTARIO INSTITUTE FOR CANCER RES OICR (CA) 2023-09-13 EP disclosed
EP-3728267-B1 TRICYCLIC INHIBITORS OF THE BCL6 BTB DOMAIN PROTEIN-PROTEIN INTERACTION AND USES THEREOF ONTARIO INSTITUTE FOR CANCER RES OICR (CA) 2023-09-13 EP disclosed
US-11518764-B2 Substituted heteroaryls as inhibitors of the BCL6 BTB domain protein-protein interaction ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2022-12-06 US disclosed
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
US-11242351-B2 Tricyclic inhibitors of the BCL6 BTB domain protein-protein interaction and uses thereof ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2022-02-08 US disclosed
US-20210053978-A1 TRICYCLIC INHIBITORS OF THE BCL6 BTB DOMAIN PROTEIN-PROTEIN INTERACTION AND USES THEREOF ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2021-02-25 US 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
US-20200331921-A1 INHIBITORS OF THE BCL6 BTB DOMAIN PROTEIN-PROTEIN INTERACTION AND USES THEREOF ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2020-10-22 US 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11518764-B2 Substituted heteroaryls as inhibitors of the BCL6 BTB domain protein-protein interaction BCL6, BCL6B, BCL3 HPGD 3576/4885KDM4E 274/4885POLB 3872/4885
US-20200331921-A1 INHIBITORS OF THE BCL6 BTB DOMAIN PROTEIN-PROTEIN INTERACTION AND USES THEREOF BCL6, BCL6B, BCL3 HPGD 3278/4885KDM4E 364/4885POLB 3681/4885
US-20210053978-A1 TRICYCLIC INHIBITORS OF THE BCL6 BTB DOMAIN PROTEIN-PROTEIN INTERACTION AND USES THEREOF BCL6, BCL6B, BCL3 HPGD 3380/4885KDM4E 434/4885POLB 3918/4885
US-11242351-B2 Tricyclic inhibitors of the BCL6 BTB domain protein-protein interaction and uses thereof BCL6, BCL6B, BCL3 HPGD 3380/4885KDM4E 434/4885POLB 3918/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.