SCHEMBL2085358

SCHEMBL2085358

Cc1c(-c2ccnc(Nc3ccc(N4CCNCC4)cc3)n2)sc(=O)n1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 9/20 1.00
CDK9 P50750 7/20 1.00
CDK7 P50613 4/20 1.00
CCNT1 O60563 3/20 1.00
AURKA O14965 6/20 0.67
AURKB Q96GD4 6/20 0.67
WEE1 P30291 3/20 0.67
FLT3 P36888 3/20 0.67
CCNE1 P24864 3/20 0.67
ALK Q9UM73 2/20 0.67
CHEK1 O14757 2/20 0.67
DAPK3 O43293 2/20 0.67
JAK2 O60674 2/20 0.67
PRKD3 O94806 2/20 0.67
PAK4 O96013 2/20 0.67
ABL1 P00519 2/20 0.67
FYN P06241 2/20 0.67
CSF1R P07333 2/20 0.67
RET P07949 2/20 0.67
MET P08581 2/20 0.67

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
SCHEMBL2076008 0.90 CDK2 (0.81) CDK2CDK9CDK7CCNT1AURKA
SCHEMBL2076613 0.89 CDK2 (0.80) CDK2CDK9CDK7CCNT1AURKA
SCHEMBL2087938 0.86 CDK2 (0.75) CDK2CDK9CDK7CCNT1AURKA
SCHEMBL2087906 0.85 CDK2 (0.75) CDK2CDK9CDK7CCNT1AURKA
SCHEMBL2087407 0.84 CDK2 (0.71) CDK2CDK9CDK7CCNT1AURKA
SCHEMBL2087314 0.84 CDK2 (0.71) CDK2CDK9CDK7CCNT1AURKA
SCHEMBL2074623 0.83 CDK2 (0.81) CDK2CDK9CDK7CCNT1AURKA
SCHEMBL2086730 0.82 GSK3B (0.70) CDK2CDK9CDK7CCNT1AURKA
SCHEMBL2086354 0.82 CDK2 (0.68) CDK2CDK9CDK7CCNT1AURKA
SCHEMBL4167442 0.81 CDK2 (0.80) CDK2CDK9CDK7CCNT1AURKA

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240299558-A1 PROTEOLYSIS TARGETING CHIMERAS AND POLYPHARMACOLOGICAL AGENTS TARGETING BCL-2, AND METHODS OF USE THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2024-09-12 US claimed
US-20240293557-A1 PROTEOLYSIS TARGETING CHIMERAS AND METHODS OF USE THEREOF UNIVERSITY OF MARYLAND, BALTIMORE 2024-09-05 US claimed
EP-3686290-B1 METHOD AND KITS FOR IDENTIFYING CDK9 INHIBITORS FOR THE TREATMENT OF CANCER MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2023-08-23 EP claimed
WO-2022261220-A1 PROTEOLYSIS TARGETING CHIMERAS AND METHODS OF USE THEREOF UNIVERSITY OF MARYLAND, BALTIMORE (US) 2022-12-15 WO claimed
EP-1678171-B1 2-AMINO-4-THIAZOLONE-PYRIMIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS CYCLACEL LTD (GB) 2016-09-14 EP claimed
US-7902361-B2 Pyrimidin-4-yl-3, 4-thione compounds and their use in therapy CYCLACEL LIMITED (GB) 2011-03-08 US claimed
US-20070021452-A1 Pyrimidin-4-YL-3, 4-thione compounds and their use in therapy CYCLACEL LIMITED (GB) 2007-01-25 US claimed
US-12636370-B2 Combination therapy for treatment of cancer INSTITUTE FOR CANCER RESEARCH (US) 2026-05-26 US disclosed
US-20250041303-A1 COMBINATION THERAPY FOR CANCER TREATMENT INSTITUTE FOR CANCER RES D/B/A THE RES INSTITUTE OF FOX CHASE CANCER CENTER (US) 2025-02-06 US disclosed
EP-4440623-A1 COMBINATION THERAPY FOR CANCER TREATMENT Institute For Cancer Research d/b/a The Research Institute of Fox Chase Cancer Center (US) 2024-10-09 EP disclosed
US-20240299558-A1 PROTEOLYSIS TARGETING CHIMERAS AND POLYPHARMACOLOGICAL AGENTS TARGETING BCL-2, AND METHODS OF USE THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2024-09-12 US disclosed
US-20240293557-A1 PROTEOLYSIS TARGETING CHIMERAS AND METHODS OF USE THEREOF UNIVERSITY OF MARYLAND, BALTIMORE 2024-09-05 US disclosed
EP-3686290-B1 METHOD AND KITS FOR IDENTIFYING CDK9 INHIBITORS FOR THE TREATMENT OF CANCER MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2023-08-23 EP disclosed
US-20080125404-A1 purine and pyrimidine derivatives such as Roscovitine or 2-[(1-ethyl-2-hydroxyethyl)amino]-6-benzylamine-9-isopropylpurine or olomoucine or purvalanol A for treating human systemic lupus erythematosus associated with antinuclear antibodies; methylprednisolone CYCLACEL LIMITED (GB) 2008-05-29 US disclosed
US-20080125404-A1 purine and pyrimidine derivatives such as Roscovitine or 2-[(1-ethyl-2-hydroxyethyl)amino]-6-benzylamine-9-isopropylpurine or olomoucine or purvalanol A for treating human systemic lupus erythematosus associated with antinuclear antibodies; methylprednisolone CYCLACEL LIMITED (GB) 2008-05-29 US disclosed
WO-2007054725-A2 COMBINATION OF A CDK-INHIBITOR AND A HDAC-INHIBITOR CYCLACEL LIMITED (GB) 2007-05-18 WO disclosed
WO-2007054725-A2 COMBINATION OF A CDK-INHIBITOR AND A HDAC-INHIBITOR CYCLACEL LIMITED (GB) 2007-05-18 WO disclosed
US-20070021452-A1 Pyrimidin-4-YL-3, 4-thione compounds and their use in therapy CYCLACEL LIMITED (GB) 2007-01-25 US disclosed
EP-1678171-A1 PYRIMIDIN-4-YL-3,4-THIONE COMPOUNDS AND THEIR USE IN THERAPY Cyclacel Limited (GB) 2006-07-12 EP disclosed
WO-2005042525-A1 PYRIMIDIN-4-YL-3, 4-THIONE COMPOUNDS AND THEIR USE IN THERAPY CYCLACEL LIMITED (GB) 2005-05-12 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 (5 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-20240299558-A1 PROTEOLYSIS TARGETING CHIMERAS AND POLYPHARMACOLOGICAL AGENTS TARGETING BCL-2, AND METHODS OF USE THEREOF BCL3, MCL1, BCL2 CDK2 741/4885CDK9 1739/4885CDK7 2337/4885
US-20240293557-A1 PROTEOLYSIS TARGETING CHIMERAS AND METHODS OF USE THEREOF MCL1, BCL3, CRBN CDK2 1951/4885CDK9 2105/4885CDK7 2426/4885
US-12636370-B2 Combination therapy for treatment of cancer RB1, MDM2, PHKB CDK2 52/4885CDK9 5/4885CDK7 158/4885
US-20070021452-A1 Pyrimidin-4-YL-3, 4-thione compounds and their use in therapy MSRB3, DHFR, CBR3 CDK2 459/4885CDK9 1001/4885CDK7 1077/4885
US-20080125404-A1 purine and pyrimidine derivatives such as Roscovitine or 2-[(1-ethyl-2-hydroxyethyl)amino]-6-benzylamine-9-isopropylpurine or olomoucine or purvalanol A for treating human systemic lupus erythematosus associated with antinuclear antibodies; methylprednisolone CDK9, SSB, CDK7 CDK2 6/4885CDK9 1/4885CDK7 3/4885

“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.