SCHEMBL21262098

SCHEMBL21262098

C[C@H]1COCCN1c1cc(N)c(Cl)cn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATR Q13535 9/20 0.47
▸ ATRIP Q8WXE1 8/20 0.47
▸ CHEK1 O14757 7/20 0.46
▸ PDCD1 Q15116 7/20 0.46
▸ CD274 Q9NZQ7 7/20 0.46
▸ PIK3CA P42336 9/20 0.43
▸ MTOR P42345 9/20 0.43
▸ PIK3R1 P27986 4/20 0.43
▸ PIK3CD O00329 2/20 0.41
▸ RICTOR Q6R327 2/20 0.41
▸ RPTOR Q8N122 2/20 0.41
▸ MAPKAP1 Q9BPZ7 2/20 0.41
▸ MLST8 Q9BVC4 2/20 0.41
▸ PIK3CB P42338 1/20 0.41
▸ PIK3CG P48736 1/20 0.41
▸ PIK3C3 Q8NEB9 1/20 0.41
▸ PDPK1 O15530 2/20 0.41
▸ ROCK1 Q13464 2/20 0.41
▸ AURKB Q96GD4 2/20 0.41
▸ AURKA O14965 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
SCHEMBL22556125 1.00 ATR (0.47) ATRATRIPCHEK1PDCD1CD274
SCHEMBL21262100 1.00 ATR (0.47) ATRATRIPCHEK1PDCD1CD274
SCHEMBL24196284 0.84 ATR (0.47) ATRATRIPCHEK1PDCD1CD274
SCHEMBL21262287 0.84 ATR (0.47) ATRATRIPCHEK1PDCD1CD274
SCHEMBL30137161 0.84 ATR (0.47) ATRATRIPCHEK1PDCD1CD274
SCHEMBL21262286 0.84 ATR (0.47) ATRATRIPCHEK1PDCD1CD274
SCHEMBL22556145 0.83 MTOR (0.45) ATRATRIPCHEK1PDCD1CD274
SCHEMBL22556144 0.83 MTOR (0.45) ATRATRIPCHEK1PDCD1CD274
SCHEMBL21262225 0.81 FPR2 (0.44) ATRATRIPPIK3CAMTORPIK3R1
SCHEMBL21262644 0.80 MTOR (0.45) ATRPIK3CAMTORPIK3R1PIK3CD

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 13 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
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-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
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-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
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 ATR 3964/4885ATRIP 1110/4885CHEK1 1794/4885
US-20200331921-A1 INHIBITORS OF THE BCL6 BTB DOMAIN PROTEIN-PROTEIN INTERACTION AND USES THEREOF BCL6, BCL6B, BCL3 ATR 4151/4885ATRIP 1278/4885CHEK1 1970/4885
US-20210053978-A1 TRICYCLIC INHIBITORS OF THE BCL6 BTB DOMAIN PROTEIN-PROTEIN INTERACTION AND USES THEREOF BCL6, BCL6B, BCL3 ATR 4089/4885ATRIP 1098/4885CHEK1 1691/4885
US-11242351-B2 Tricyclic inhibitors of the BCL6 BTB domain protein-protein interaction and uses thereof BCL6, BCL6B, BCL3 ATR 4089/4885ATRIP 1098/4885CHEK1 1691/4885

“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.

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