SCHEMBL23000258

SCHEMBL23000258

COC(=O)c1c(CNC(=O)OC(C)(C)C)c2c(Br)c(Cl)ccc2n1CCCOc1cc(SCc2ccc(OC)cc2)cc2ccccc12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.34
MAPK8 P45983 7/20 0.33
MARK3 P27448 2/20 0.32
SYK P43405 2/20 0.32
GSK3B P49841 2/20 0.32
PLK1 P53350 2/20 0.32
CAMK2B Q13554 2/20 0.32
MARK2 Q7KZI7 2/20 0.32
MINK1 Q8N4C8 2/20 0.32
SRPK1 Q96SB4 2/20 0.32
HIPK2 Q9H2X6 2/20 0.32
PLK3 Q9H4B4 2/20 0.32
CDC7 O00311 1/20 0.32
IRAK1 P51617 1/20 0.32
NEK4 P51957 1/20 0.32
MAP4K2 Q12851 1/20 0.32
CDC42BPA Q5VT25 1/20 0.32
TAOK1 Q7L7X3 1/20 0.32
HIPK4 Q8NE63 1/20 0.32
AURKB Q96GD4 1/20 0.32

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
SCHEMBL25248815 0.92 TP53 (0.35) DYRK1AMAPK8POLBPTGS2ALDH1A1
SCHEMBL25249377 0.92 MAPK8 (0.35) MAPK8MARK3SYKGSK3BPLK1
SCHEMBL23000228 0.86 MARK3 (0.37) MAPK8MARK3SYKGSK3BPLK1
SCHEMBL25786220 0.86 MARK3 (0.37) DYRK1AMAPK8MARK3SYKGSK3B
SCHEMBL25250674 0.85 SIRT2 (0.35) MAPK8MARK3SYKGSK3BPLK1
SCHEMBL25250550 0.81 ALOX5 (0.38) MARK3SYKGSK3BPLK1CAMK2B
SCHEMBL25246284 0.80 TP53 (0.36) MAPK8POLBALDH1A1KDM4EMAPT
SCHEMBL25293250 0.80 TP53 (0.35) POLBALDH1A1KDM4EMAPTNPSR1
SCHEMBL25292064 0.79 BAD (0.33) MAPK8
SCHEMBL25786239 0.78 MAPK8 (0.35) DYRK1AMAPK8MARK3SYKGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11691989-B2 Macrocyclic indoles as Mcl-1 inhibitors ASCENTAGE PHARMA (SUZHOU) CO., LTD. (CN) 2023-07-04 US disclosed
US-20220340595-A1 MACROCYCLIC INDOLES AS MCL-1 INHIBITORS ASCENTAGE PHARMA (SUZHOU) CO., LTD. (CN) 2022-10-27 US disclosed
CN-110845520-B Macrocyclic indoles as MCL-1 inhibitors 苏州亚盛药业有限公司 2021-04-13 CN disclosed
EP-3781570-A1 MACROCYCLIC INDOLES AS MCL-1 INHIBITORS Ascentage Pharma (Suzhou) Co., Ltd. (CN) 2021-02-24 EP disclosed
CN-110845520-A Macrocyclic indoles as MCL-1 inhibitors 苏州亚盛药业有限公司 2020-02-28 CN 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 (2 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-20220340595-A1 MACROCYCLIC INDOLES AS MCL-1 INHIBITORS MCL1, BCL2A1, BCL2L1 DYRK1A 1043/4885MAPK8 3126/4885MARK3 1429/4885
US-11691989-B2 Macrocyclic indoles as Mcl-1 inhibitors MCL1, BCL2A1, BCL2L1 DYRK1A 1043/4885MAPK8 3126/4885MARK3 1429/4885

“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.